Reference Materials
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HeneicosaneCas#: 629-94-7 Compound CID: 12403Formula: C21H44 Molecular Weight: 296.57IUPAC Name: henicosaneSMILES: CCCCCCCCCCCCCCCCCCCCCInChIKey: FNAZRRHPUDJQCJ-UHFFFAOYSA-NInChI: InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3Synonyms: HY-W089845 | n-Heneicosane | Henicosane | H0367 | I93S5U5DMP | CHEBI:32931 | UNII-I93S5U5DMP | Heneicosane, analytica...
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2-UndecanoneCas#: 112-12-9 Compound CID: 8163Formula: C11H22O Molecular Weight: 170.29IUPAC Name: undecan-2-oneSMILES: CCCCCCCCCC(=O)CInChIKey: KYWIYKKSMDLRDC-UHFFFAOYSA-NInChI: InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3Synonyms: methyl n-nonylketone | CCG-266363 | 2-Undecanone, >=98%, FCC, FG | Enodyl | HY-W016969 | 2-UNDECANONE [FCC] | A802493...
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2-methylpentaneCas#: 107-83-5 Compound CID: 7892Formula: C6H14 Molecular Weight: 86.17IUPAC Name: 2-methylpentaneSMILES: CCCC(C)CInChIKey: AFABGHUZZDYHJO-UHFFFAOYSA-NInChI: InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3Synonyms: 2-METHYLPENTANE|Isohexane|107-83-5|Pentane, 2-methyl-|73513-42-5|2-Methyl pentane|1,1-Dimethylbutane|Hexanes|2-Methyl...
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DicyclohexylamineCas#: 101-83-7 Compound CID: 7582Formula: C12H23N Molecular Weight: 181.32IUPAC Name: N-cyclohexylcyclohexanamineSMILES: C1CCC(CC1)NC2CCCCC2InChIKey: XBPCUCUWBYBCDP-UHFFFAOYSA-NInChI: InChI=1S/C12H23N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2Synonyms: UNII-1A93RJW924 | FT-0624742 | BIDD:ER0258 | Dicyclohexylamine, 99% | STR04129 | Tox21_111044 | N,N-DICYCLOHXYL-AMINE...
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DiethylamineCas#: 109-89-7 Compound CID: 8021Formula: C4H11N Molecular Weight: 73.14IUPAC Name: N-ethylethanamineSMILES: CCNCCInChIKey: HPNMFZURTQLUMO-UHFFFAOYSA-NInChI: InChI=1S/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3Synonyms: DIETHYLAMINE|N-Ethylethanamine|109-89-7|N,N-Diethylamine|Diethamine|Ethanamine, N-ethyl-|Diaethylamin|Dietilamina|Dwu...
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Diethylene glycolCas#: 111-46-6 Compound CID: 8117Formula: C4H10O3 Molecular Weight: 106.12IUPAC Name: 2-(2-hydroxyethoxy)ethanolSMILES: C(COCCO)OInChIKey: MTHSVFCYNBDYFN-UHFFFAOYSA-NInChI: InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2Synonyms: BIDD:ER0301 | DEG | HO(CH2)2O(CH2)2OH | PEG 200 | Diethylenglykol rein | Diglykol | EC 203-872-2 | beta,beta'-Dihydro...
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HeptadecaneCas#: 629-78-7 Compound CID: 12398Formula: C17H36 Molecular Weight: 240.47IUPAC Name: heptadecaneSMILES: CCCCCCCCCCCCCCCCCInChIKey: NDJKXXJCMXVBJW-UHFFFAOYSA-NInChI: InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3Synonyms: CAS-629-78-7 | NSC 172782 | Heptadecane; NSC 172782; TS 7; n-Heptadecane | HSDB 8347 | C01816 | Heptadecane purum | n...
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Isoamyl acetateCas#: 123-92-2 Compound CID: 31276Formula: C7H14O2 Molecular Weight: 130.19IUPAC Name: 3-methylbutyl acetateSMILES: CC(C)CCOC(=O)CInChIKey: MLFHJEHSLIIPHL-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c1-6(2)4-5-9-7(3)8/h6H,4-5H2,1-3H3Synonyms: 3-Methyl-1-butanol acetate | 3-Methyl-1-butanyl acetate | HSDB 1818 | Z135787824 | 3-Methyl butyl ester acetic acid |...
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DiisopropylamineCas#: 108-18-9 Compound CID: 7912Formula: C6H15N Molecular Weight: 101.19IUPAC Name: N-propan-2-ylpropan-2-amineSMILES: CC(C)NC(C)CInChIKey: UAOMVDZJSHZZME-UHFFFAOYSA-NInChI: InChI=1S/C6H15N/c1-5(2)7-6(3)4/h5-7H,1-4H3Synonyms: DIISOPROPYLAMINE|108-18-9|N-(1-Methylethyl)-2-propanamine|N,N-Diisopropylamine|2-Propanamine, N-(1-methylethyl)-|N-pr...
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Isoamyl butyrateCas#: 106-27-4 Compound CID: 7795Formula: C9H18O2 Molecular Weight: 158.24IUPAC Name: 3-methylbutyl butanoateSMILES: CCCC(=O)OCCC(C)CInChIKey: PQLMXFQTAMDXIZ-UHFFFAOYSA-NInChI: InChI=1S/C9H18O2/c1-4-5-9(10)11-7-6-8(2)3/h8H,4-7H2,1-3H3Synonyms: iso-Amyl n-butyrate | Isoamyl n-Butyrate | B0760 | LMFA07010574 | CCRIS 6556 | E75851 | FT-0627328 | 3-Methylbutyl bu...
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IsobutylbenzeneCas#: 538-93-2 Compound CID: 10870Formula: C10H14 Molecular Weight: 134.22IUPAC Name: 2-methylpropylbenzeneSMILES: CC(C)CC1=CC=CC=C1InChIKey: KXUHSQYYJYAXGZ-UHFFFAOYSA-NInChI: InChI=1S/C10H14/c1-9(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3Synonyms: isobutyl benzene | NSC24848 | NSC-24848 | ISOBUTYLBENZENE [MI] | Q16912105 | UNII-FI94T26KGB | WLN: 1Y1&1R | EINECS 2...
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IsobutylbenzeneCas#: 538-93-2 Compound CID: 10870Formula: C10H14 Molecular Weight: 134.22IUPAC Name: 2-methylpropylbenzeneSMILES: CC(C)CC1=CC=CC=C1InChIKey: KXUHSQYYJYAXGZ-UHFFFAOYSA-NInChI: InChI=1S/C10H14/c1-9(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3Synonyms: ISOBUTYLBENZENE|538-93-2|(2-Methylpropyl)benzene|Benzene, (2-methylpropyl)-|2-Methyl-1-phenylpropane|2-methylpropylbe...