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Abieta-8,12-diene
SpectraBase Compound ID I6hX6dQg5YK
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,14,18H,6,8-13H2,1-5H3/t18-,20+/m0/s1
InChIKey BGVUIJDZTQIJIO-AZUAARDMSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qTLQCbmckO
Name Abieta-8,12-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32
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/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,14,18H,6,8-13H2,1-5H3/t18-,20+/m0/s1
InChIKey BGVUIJDZTQIJIO-AZUAARDMSA-N
Molecular Weight 272.476 g/mol
SMILES C1CC([C@]2([C@](C1)(C1=C(CC2)CC(=CC1)C(C)C)C)[H])(C)C
SPLASH splash10-0006-9600000000-f5f62d880763bf0d2370
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1885764