Reference Materials
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Allyl chlorideCas#: 107-05-1Formula: C3H5CL Molecular Weight: 76.52IUPAC Name: 3-chloroprop-1-eneSMILES: C=CCClInChIKey: OSDWBNJEKMUWAV-UHFFFAOYSA-NInChI: InChI=1S/C3H5Cl/c1-2-3-4/h2H,1,3H2Synonyms: 3-Chloropropene-1 | CHEBI:82379 | Allyl chloride, ReagentPlus(R), 99% | p-Aminopropiofenon [Czech] | 3-Chloro-1-propy...
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OctacosaneCas#: 630-02-4 Compound CID: 12408Formula: C28H58 Molecular Weight: 394.76IUPAC Name: octacosaneSMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCInChIKey: ZYURHZPYMFLWSH-UHFFFAOYSA-NInChI: InChI=1S/C28H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3Synonyms: OCTACOSANE|n-Octacosane|630-02-4|Octacosane, n-|CCRIS 680|UNII-VFF49836P8|VFF49836P8|NSC 5549|NSC-5549|EINECS 211-125...
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AlbiflorinCas#: 39011-90-0 Compound CID: 24868421Formula: C23H28O11 Molecular Weight: 480.46IUPAC Name: [(1R,3R,4R,6S,9S)-4-hydroxy-6-methyl-8-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]methyl benzoateSMILES: CC12CC(C3CC1(C3(C(=O)O2)COC(=O)C4=CC=CC=C4)OC5C(C(C(C(O5)CO)O)O)O)OInChIKey: QQUHMASGPODSIW-ICECTASOSA-NInChI: InChI=1S/C23H28O11/c1-21-8-13(25)12-7-23(21,33-19-17(28)16(27)15(26)14(9-24)32-19)22(12,20(30)34-21)10-31-18(29)11-5-3-2-4-6-11/h2-6,12-17,19,24-28H,7-10H2,1H3/t12-,13+,14+,15+,16-,17+,19-,21-,22-,23-/m0/s1Synonyms: BRD-K76724902-001-01-6 | C17457 | [(1R,3R,4R,6S,9S)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyc...
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Arachidonic acidCas#: 506-32-1 Compound CID: 444899Formula: C20H32O2 Molecular Weight: 304.47IUPAC Name: (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acidSMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)OInChIKey: YZXBAPSDXZZRGB-DOFZRALJSA-NInChI: InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-Synonyms: 5,8,11,14-Eicosatetraenoic acid | C00219 | (5Z,8Z,11Z,14Z)-Icosatetraenoic acid | A0781 | Immunocytophyte | 5,8,11,14...
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Bis(2-ethylhexyl) sebacateCas#: 122-62-3Formula: C26H50O4 Molecular Weight: 426.67IUPAC Name: bis(2-ethylhexyl) decanedioateSMILES: CCCCC(CC)COC(=O)CCCCCCCCC(=O)OCC(CC)CCCCInChIKey: VJHINFRRDQUWOJ-UHFFFAOYSA-NInChI: InChI=1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3Synonyms: BIS(2-ETHYLHEXYL) SEBACATE|122-62-3|Bis(2-ethylhexyl) decanedioate|Bis(2-ethylhexyl)sebacate|Bisoflex|Di(2-ethylhexyl...
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γ-DodecalactoneCas#: 2305-05-7 Compound CID: 16821Formula: C12H22O2 Molecular Weight: 198.3IUPAC Name: 5-octyloxolan-2-oneSMILES: CCCCCCCCC1CCC(=O)O1InChIKey: WGPCZPLRVAWXPW-UHFFFAOYSA-NInChI: InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h11H,2-10H2,1H3Synonyms: gamma-Dodecalactone|4-Dodecanolide|2305-05-7|5-octyloxolan-2-one|2(3H)-Furanone, dihydro-5-octyl-|GAMMA-DODECANOLACTO...