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4-BETA-HYDROXYMETHYLISOMANOOL
SpectraBase Compound ID 4HiLGw6I26F
InChI InChI=1S/C20H34O2/c1-6-19(4,22)13-10-16-15(2)8-9-17-18(3,14-21)11-7-12-20(16,17)5/h6,16-17,21-22H,1-2,7-14H2,3-5H3
InChIKey IERFAZQCIAZODG-UHFFFAOYSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KeLnXvh868w
Name Torulosol
CAS Registry Number 1908-44-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
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/C20H34O2/c1-6-19(4,22)13-10-16-15(2)8-9-17-18(3,14-21)11-7-12-20(16,17)5/h6,16-17,21-22H,1-2,7-14H2,3-5H3
InChIKey IERFAZQCIAZODG-UHFFFAOYSA-N
Molecular Weight 306.490 g/mol
SMILES OCC1(C2C(C(CCC(C=C)(C)O)C(CC2)=C)(C)CCC1)C
SPLASH splash10-052f-9710000000-84882a0db248c8cbdaf9
Source ex CUPRESSUS ATLANTICA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887864