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1,5,11-trimethyl-8-(1-methylethyl)-,1,6,12-tetradecen-3,5,11-triol- [3R,5S,8S,11S]-
SpectraBase Compound ID FPQVAD98zr2
InChI InChI=1S/C20H34O3/c1-15(2)17-8-11-19(4,22)10-6-7-16(3)13-18(21)14-20(5,23)12-9-17/h6,9-10,12-13,15,17-18,21-23H,7-8,11,14H2,1-5H3/b10-6+,12-9+,16-13+/t17-,18+,19-,20-/m1/s1
InChIKey YJLCVIWLVFUFET-ADOFOBMCSA-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 8hV1IZFLrZC
Name 1,5,11-trimethyl-8-(1-methylethyl)-,1,6,12-tetradecen-3,5,11-triol- [3R,5S,8S,11S]-
CAS Registry Number 57688-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-15(2)17-8-11-19(4,22)10-6-7-16(3)13-18(21)14-20(5,23)12-9-17/h6,9-10,12-13,15,17-18,21-23H,7-8,11,14H2,1-5H3/b10-6+,12-9+,16-13+/t17-,18+,19-,20-/m1/s1
InChIKey YJLCVIWLVFUFET-ADOFOBMCSA-N
Molecular Weight 322.489 g/mol
SMILES O[C@]1(CC[C@](\C=C\[C@](C[C@](\C=C\(C\C=C\1)C)(O)[H])(O)C)(C(C)C)[H])C
SPLASH splash10-0537-9400000000-563ec0916bb027a5741e
Source of Spectrum SB-36-151-0
Synonyms (1S,2E,4S,6R,7E,10E,12S)-2,7,10-Cembratriene-4,6,12-triol
Wiley ID 1306874