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2,8-Chrysenediol, 4b,5,6,10b,11,12-hexahydro-4b-methyl-, trans-
SpectraBase Compound ID IAjm026wDxw
InChI InChI=1S/C19H20O2/c1-19-9-8-12-10-14(20)3-5-16(12)18(19)6-2-13-11-15(21)4-7-17(13)19/h3-5,7,10-11,18,20-21H,2,6,8-9H2,1H3/t18-,19+/m0/s1
InChIKey XYUHANYIWAKGKA-RBUKOAKNSA-N
Mol Weight 280.37 g/mol
Molecular Formula C19H20O2
Exact Mass 280.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32gMcMMjlGR
Name 2,8-Chrysenediol, 4b,5,6,10b,11,12-hexahydro-4b-methyl-, trans-
CAS Registry Number 71505-86-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O2
InChI InChI=1S/C19H20O2/c1-19-9-8-12-10-14(20)3-5-16(12)18(19)6-2-13-11-15(21)4-7-17(13)19/h3-5,7,10-11,18,20-21H,2,6,8-9H2,1H3/t18-,19+/m0/s1
InChIKey XYUHANYIWAKGKA-RBUKOAKNSA-N
Molecular Weight 280.367 g/mol
SMILES Oc1ccc2[C@]3([C@@](c4ccc(cc4CC3)O)(CCc2c1)C)[H]
SPLASH splash10-0159-1290000000-dc752d6b9ed2799d0d4f
Source of Spectrum B-32-1105-0
Synonyms (4bS,10bR)-4b-methyl-4b,5,6,10b,11,12-hexahydro-2,8-chrysenediol 4b-methyl-trans-4b,5,6,10b,11,12-hexahydrochrysene-2,8-diol
Wiley ID 1284383