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(1S,2E,5S,6E,8S,12S)-2,8,12-trimethyl-8-oxidanyl-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-10-one
SpectraBase Compound ID EHELOGWvs8N
InChI InChI=1S/C20H32O3/c1-14(2)16-7-6-15(3)18-9-11-20(5,23-18)13-17(21)12-19(4,22)10-8-16/h6,8,10,14,16,18,22H,7,9,11-13H2,1-5H3/b10-8+,15-6+/t16-,18+,19-,20+/m1/s1
InChIKey LKOKCLMYMYOOIB-AAHGTGSSSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOdyxhp0vdY
Name (1S,2E,5S,6E,8S,12S)-2,8,12-trimethyl-8-oxidanyl-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-10-one
CAS Registry Number 98167-31-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-14(2)16-7-6-15(3)18-9-11-20(5,23-18)13-17(21)12-19(4,22)10-8-16/h6,8,10,14,16,18,22H,7,9,11-13H2,1-5H3/b10-8+,15-6+/t16-,18+,19-,20+/m1/s1
InChIKey LKOKCLMYMYOOIB-AAHGTGSSSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@@]1(\C=C\[C@@](C\C=C\([C@]2(O[C@](CC(C1)=O)(CC2)C)[H])C)(C(C)C)[H])C
SPLASH splash10-0006-9100000000-5eee306fdb0c2e58c522
Source of Spectrum J-50-4537-18
Synonyms (1S,2E,5S,6E,8S,12S)-8-hydroxy-2,8,12-trimethyl-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-10-one (1S,2E,5S,6E,8S,12S)-8-hydroxy-5-isopropyl-2,8,12-trimethyl-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-10-one
Wiley ID 1320435