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  1. Bergamottin
    Cas#: 7380-40-7        Compound CID:  5471349
    Formula:  C21H22O4        Molecular Weight: 338.40
    IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
    SMILES: CC(=CCCC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C)C
    InChIKey: DBMJZOMNXBSRED-OQLLNIDSSA-N
    InChI: InChI=1S/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-16-7-8-20(22)25-19(16)13-18-17(21)10-12-23-18/h5,7-10,12-13H,4,6,11H2,1-3H3/b15-9+
    Synonyms: Bergamottin | Bergaptol geranyl ether | Bergaptin | NSC710599 | NSC-710599 | Bergamotine | Bergamotine | 5-Androsten-...
  2. p-Nitrotoluene Standard
    Cas#: 99-99-0        Compound CID:  7473
    Formula:  C7H7NO2        Molecular Weight: 137.14
    IUPAC Name: 1-methyl-4-nitrobenzene
    SMILES: CC1=CC=C(C=C1)[N+](=O)[O-]
    InChIKey: ZPTVNYMJQHSSEA-UHFFFAOYSA-N
    InChI: InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3
    Synonyms: 4-NITROPHENYLMETHANE | p-Methylnitrobenzene | 4-Methylnitrobenzene | CCRIS 2313 | NCGC00259015-01 | SCHEMBL7147554 | ...
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