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DEHYDROABIETANOL
SpectraBase Compound ID CAkIG4sT4fI
InChI InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18,21H,5,7,9-11,13H2,1-4H3/t18-,19-,20+/m0/s1
InChIKey WSKGRAGZAQRSED-SLFFLAALSA-N
Mol Weight 286.46 g/mol
Molecular Formula C20H30O
Exact Mass 286.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J9UOfi58Jv
Name Dehydroabietol
CAS Registry Number 3772-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18,21H,5,7,9-11,13H2,1-4H3/t18-,19-,20+/m0/s1
InChIKey WSKGRAGZAQRSED-SLFFLAALSA-N
Molecular Weight 286.459 g/mol
SMILES OC[C@]1([C@]2([C@@](C)(c3c(CC2)cc(cc3)C(C)C)CCC1)[H])C
SPLASH splash10-0fk9-1950000000-393d40259313dbed0e40
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1885771