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(1S,2E,4R,6R,7E,11Z)-2,7,11-Cembratriene-4,6,20-triol
SpectraBase Compound ID BYoh7w9nNGi
InChI InChI=1S/C20H34O3/c1-15(2)18-9-8-17(14-21)7-5-6-16(3)12-19(22)13-20(4,23)11-10-18/h7,10-12,15,18-19,21-23H,5-6,8-9,13-14H2,1-4H3/b11-10+,16-12+,17-7+/t18-,19+,20+/m1/s1
InChIKey DRFIFRGBTCQTOB-MNYBSVHRSA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtEadHZwkKX
Name (1S,2E,4R,6R,7E,11Z)-2,7,11-Cembratriene-4,6,20-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-15(2)18-9-8-17(14-21)7-5-6-16(3)12-19(22)13-20(4,23)11-10-18/h7,10-12,15,18-19,21-23H,5-6,8-9,13-14H2,1-4H3/b11-10+,16-12+,17-7+/t18-,19+,20+/m1/s1
InChIKey DRFIFRGBTCQTOB-MNYBSVHRSA-N
Molecular Weight 322.489 g/mol
SMILES OC\C=1CC[C@](\C=C\[C@@](C[C@](\C=C\(CCC/1)C)(O)[H])(O)C)(C(C)C)[H]
SPLASH splash10-052f-9300000000-d3778fd97bc4a3892e95
Source of Spectrum SB-47-86-11
Synonyms (1R,3R,12S)-9-(hydroxymethyl)-12-isopropyl-1,5-dimethyl-4,8,13-cyclotetradecatriene-1,3-diol
Wiley ID 1322052