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(1S,3R,4E,7S,8E,12S,13E)-1,5,9-trimethyl-12-propan-2-yl-cyclotetradeca-4,8,13-triene-1,3,7-triol
SpectraBase Compound ID 4s1wKWbvhKb
InChI InChI=1S/C20H34O3/c1-14(2)17-7-6-15(3)10-18(21)11-16(4)12-19(22)13-20(5,23)9-8-17/h8-10,12,14,17-19,21-23H,6-7,11,13H2,1-5H3/b9-8+,15-10+,16-12+/t17-,18-,19+,20-/m1/s1
InChIKey ZRUCLTHCKNSADG-WXHBCMKYSA-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 QymgXuS9NS
Name (1S,3R,4E,7S,8E,12S,13E)-1,5,9-trimethyl-12-propan-2-yl-cyclotetradeca-4,8,13-triene-1,3,7-triol
Alternate Name(s) (1S,3R,4E,7S,8E,12S,13E)-12-isopropyl-1,5,9-trimethyl-cyclotetradeca-4,8,13-triene-1,3,7-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-14(2)17-7-6-15(3)10-18(21)11-16(4)12-19(22)13-20(5,23)9-8-17/h8-10,12,14,17-19,21-23H,6-7,11,13H2,1-5H3/b9-8+,15-10+,16-12+/t17-,18-,19+,20-/m1/s1
InChIKey ZRUCLTHCKNSADG-WXHBCMKYSA-N
Molecular Weight 322.489 g/mol
SMILES O[C@@]1(\C=C\(CC[C@](\C=C\[C@](C[C@](\C=C\(C1)C)(O)[H])(O)C)(C(C)C)[H])C)[H]
SPLASH splash10-0a4i-9200000000-d95b2d4a5214ae7ed7b8
Source of Spectrum SB-47-688-6
Wiley ID 1322057