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(1S,2R,5S,6E,8S,12R)-2,8,12-trimethyl-2,8-bis(oxidanyl)-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadec-6-en-10-one
SpectraBase Compound ID 8IUuZP2HfQu
InChI InChI=1S/C20H34O4/c1-14(2)15-6-9-18(3,22)12-16(21)13-19(4)10-8-17(24-19)20(5,23)11-7-15/h6,9,14-15,17,22-23H,7-8,10-13H2,1-5H3/b9-6+/t15-,17-,18+,19+,20+/m0/s1
InChIKey QJRRHHOUFMWXGC-QEKUVEPGSA-N
Mol Weight 338.5 g/mol
Molecular Formula C20H34O4
Exact Mass 338.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZACMx58XGU
Name (1S,2R,5S,6E,8S,12R)-2,8,12-trimethyl-2,8-bis(oxidanyl)-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadec-6-en-10-one
CAS Registry Number 98064-77-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O4
InChI InChI=1S/C20H34O4/c1-14(2)15-6-9-18(3,22)12-16(21)13-19(4)10-8-17(24-19)20(5,23)11-7-15/h6,9,14-15,17,22-23H,7-8,10-13H2,1-5H3/b9-6+/t15-,17-,18+,19+,20+/m0/s1
InChIKey QJRRHHOUFMWXGC-QEKUVEPGSA-N
Molecular Weight 338.488 g/mol
SMILES O[C@@]1(CC[C@](\C=C\[C@](CC(C[C@@]2(O[C@]1(CC2)[H])C)=O)(O)C)(C(C)C)[H])C
SPLASH splash10-0006-9600000000-201bfeaaac8665b673d1
Source of Spectrum J-50-4536-5
Synonyms (1S,2R,5S,6E,8S,12R)-2,8-dihydroxy-2,8,12-trimethyl-5-propan-2-yl-15-oxabicyclo[10.2.1]pentadec-6-en-10-one (1S,2R,5S,6E,8S,12R)-2,8-dihydroxy-5-isopropyl-2,8,12-trimethyl-15-oxabicyclo[10.2.1]pentadec-6-en-10-one
Wiley ID 1333945