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

*Links on SpectraBase are not permalinks.
(3R)-3-[(3S)-2-ketotetrahydropyran-3-yl]-4-methyl-valeric acid methyl ester
SpectraBase Compound ID 4PTOpBsU7sQ
InChI InChI=1S/C12H20O4/c1-8(2)10(7-11(13)15-3)9-5-4-6-16-12(9)14/h8-10H,4-7H2,1-3H3/t9-,10+/m0/s1
InChIKey PLGXSSXJPZTOIV-VHSXEESVSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 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 Hm9vJv3xjRN
Name (3R)-3-[(3S)-2-ketotetrahydropyran-3-yl]-4-methyl-valeric acid methyl ester
Alternate Name(s) (3R)-4-methyl-3-[(3S)-2-oxo-3-oxanyl]pentanoic acid methyl ester Methyl (3R)-4-methyl-3-[(3S)-2-oxidanylideneoxan-3-yl]pentanoate Methyl (3R)-4-methyl-3-[(3S)-2-oxooxan-3-yl]pentanoate Methyl (3R)-4-methyl-3-[(3S)-2-oxotetrahydropyran-3-yl]pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-8(2)10(7-11(13)15-3)9-5-4-6-16-12(9)14/h8-10H,4-7H2,1-3H3/t9-,10+/m0/s1
InChIKey PLGXSSXJPZTOIV-VHSXEESVSA-N
Molecular Weight 228.288 g/mol
SMILES C1([C@]([C@](CC(=O)OC)(C(C)C)[H])(CCCO1)[H])=O
SPLASH splash10-0udi-9700000000-77b117238bf1f1956d62
Source of Spectrum SO-0-240-5
Wiley ID 876213