For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(1R,2R,6S,7S,8R,9S,12Z)-6-Acetyl-9-hydroxy-9,13-dimethyl-15-oxatricyclo[6.6.1.02,7]-pentadec-12-en-3-one
SpectraBase Compound ID 8JWY0QHnCCc
InChI InChI=1S/C18H26O4/c1-10-5-4-8-18(3,21)17-15-12(11(2)19)6-7-13(20)16(15)14(9-10)22-17/h5,12,14-17,21H,4,6-9H2,1-3H3/b10-5-/t12-,14-,15-,16-,17-,18+/m1/s1
InChIKey WISUZGZQDFKRMQ-QHGAWVSGSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9U8h6RIcCIn
Name (1R,2R,6S,7S,8R,9S,12Z)-6-Acetyl-9-hydroxy-9,13-dimethyl-15-oxatricyclo[6.6.1.02,7]-pentadec-12-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-10-5-4-8-18(3,21)17-15-12(11(2)19)6-7-13(20)16(15)14(9-10)22-17/h5,12,14-17,21H,4,6-9H2,1-3H3/b10-5-/t12-,14-,15-,16-,17-,18+/m1/s1
InChIKey WISUZGZQDFKRMQ-QHGAWVSGSA-N
Literature Reference DOI 10.1021/ol5020152
Molecular Weight 306.402 g/mol
SMILES O[C@@]1([C@]2([C@]3([C@@]([C@](O2)(C\C(=C/CC1)C)[H])(C(CC[C@@]3(C(C)=O)[H])=O)[H])[H])[H])C
SPLASH splash10-01po-0901000000-6a2e62aeb1972705f8e3
Source of Spectrum A1-16-4300/SM11-21
Synonyms (4S,4aR,5R,6S,12R,12aS,Z)-4-acetyl-6-hydroxy-6,10-dimethyl-2,3,4,4a,5,6,7,8,12,12a-decahydro-5,12-epoxybenzo[10]annulen-1(11H)-one
Wiley ID 1751172