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

*Links on SpectraBase are not permalinks.
[3aR-(3aR*,4R*,5E,9E,11aR*)]-4-(acetyloxy)-3a,4,7,8,11,11a-hexahydro-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one
SpectraBase Compound ID AfdvP93o01
InChI InChI=1S/C17H24O5/c1-10-5-4-6-13(9-18)8-15-16(11(2)17(20)22-15)14(7-10)21-12(3)19/h6-7,11,14-16,18H,4-5,8-9H2,1-3H3/b10-7+,13-6+/t11?,14-,15-,16+/m1/s1
InChIKey YISTUGWYCKPCBX-QKMVHZTOSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 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 3U25WjHwQlA
Name [3aR-(3aR*,4R*,5E,9E,11aR*)]-4-(acetyloxy)-3a,4,7,8,11,11a-hexahydro-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one
CAS Registry Number 90605-36-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-10-5-4-6-13(9-18)8-15-16(11(2)17(20)22-15)14(7-10)21-12(3)19/h6-7,11,14-16,18H,4-5,8-9H2,1-3H3/b10-7+,13-6+/t11?,14-,15-,16+/m1/s1
InChIKey YISTUGWYCKPCBX-QKMVHZTOSA-N
Molecular Weight 308.374 g/mol
SMILES OC\C=1C[C@]2(OC(C([C@]2([C@@](\C=C\(CCC/1)C)(OC(=O)C)[H])[H])C)=O)[H]
SPLASH splash10-0006-9300000000-a3f7215f643f2902784e
Source of Spectrum J-49-2996-0
Synonyms (3aR,4R,11aR)-10-(hydroxymethyl)-3,6-dimethyl-2-oxo-2,3,3a,4,7,8,11,11a-octahydrocyclodeca[b]furan-4-yl acetate
Wiley ID 1309787