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Benzo[g]chrysene-11,12-diol, 11,12,13,14-tetrahydro-, trans-(.+-.)-
SpectraBase Compound ID APAnXwh8hsS
InChI InChI=1S/C22H18O2/c23-20-12-11-18-19(22(20)24)10-9-17-15-7-2-1-5-13(15)14-6-3-4-8-16(14)21(17)18/h1-10,20,22-24H,11-12H2/t20-,22-/m1/s1
InChIKey YQZOKKNYOIZPPR-IFMALSPDSA-N
Mol Weight 314.38 g/mol
Molecular Formula C22H18O2
Exact Mass 314.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5W1Lu0kQbR5
Name Benzo[g]chrysene-11,12-diol, 11,12,13,14-tetrahydro-, trans-(.+-.)-
Alternate Name(s) (11R,12R)-11,12,13,14-tetrahydrobenzo[g]chrysene-11,12-diol trans-11,12-dihydroxy-11,12,13,14-tetrahydrobenzo[g]chrysene
CAS Registry Number 122048-32-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O2
InChI InChI=1S/C22H18O2/c23-20-12-11-18-19(22(20)24)10-9-17-15-7-2-1-5-13(15)14-6-3-4-8-16(14)21(17)18/h1-10,20,22-24H,11-12H2/t20-,22-/m1/s1
InChIKey YQZOKKNYOIZPPR-IFMALSPDSA-N
Molecular Weight 314.384 g/mol
SMILES O[C@@]1(c2ccc3c(c2CC[C@]1(O)[H])c1c(c2ccccc32)cccc1)[H]
SPLASH splash10-044m-0093000000-78e7f1a4e5897ab5eb8e
Source of Spectrum J-54-3540-11
Wiley ID 1315656