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

*Links on SpectraBase are not permalinks.
Acetic acid (4aR,6S,7R,7aS)-7-methyl-3-oxo-octahydro-cyclopenta[c]pyran-6-yl ester
SpectraBase Compound ID HMjpF3mmAFt
InChI InChI=1S/C11H16O4/c1-6-9-5-14-11(13)4-8(9)3-10(6)15-7(2)12/h6,8-10H,3-5H2,1-2H3/t6-,8-,9-,10+/m1/s1
InChIKey MBJHSEZGXPVNLN-QQRDMOCMSA-N
Mol Weight 212.24 g/mol
Molecular Formula C11H16O4
Exact Mass 212.104859 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 9fDLUWSZBIo
Name Acetic acid (4aR,6S,7R,7aS)-7-methyl-3-oxo-octahydro-cyclopenta[c]pyran-6-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O4
InChI InChI=1S/C11H16O4/c1-6-9-5-14-11(13)4-8(9)3-10(6)15-7(2)12/h6,8-10H,3-5H2,1-2H3/t6-,8-,9-,10+/m1/s1
InChIKey MBJHSEZGXPVNLN-QQRDMOCMSA-N
Molecular Weight 212.245 g/mol
SMILES [C@@]1([C@@]([C@]2(COC(C[C@]2(C1)[H])=O)[H])(C)[H])(OC(=O)C)[H]
SPLASH splash10-0w93-2900000000-9b0b7363251dd1b0b018
Source of Spectrum E2-46-1453-19
Synonyms (4aR,6R,7aS)-Tetrahydro-6-acetoxy-7-methylcyclopenta[c]pyran-3(1H)-one (4aR,6S,7R,7aS)-7-methyl-3-oxooctahydrocyclopenta[c]pyran-6-yl acetate Acetic acid[(4aR,6S,7R,7aS)-3-keto-7-methyl-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl]ester Acetic acid[(4aR,6S,7R,7aS)-7-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl]ester [(4aR,6S,7R,7aS)-7-methyl-3-oxidanylidene-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl]ethanoate [(4aR,6S,7R,7aS)-7-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl]acetate Acetic acid [(4aR,6S,7R,7aS)-7-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl] ester [(4aR,6S,7R,7aS)-7-methyl-3-oxo-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl] acetate [(4aR,6S,7R,7aS)-7-methyl-3-oxidanylidene-4,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyran-6-yl] ethanoate
Wiley ID 1554593