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

*Links on SpectraBase are not permalinks.
(1S,4S,5R)-5-Methyl-4-pivaloyloxymethyl-6,6,7,7-tetramethyl-3-oxabicyclo[3.2.0]heptan-2-one
SpectraBase Compound ID 9HfD2zOjipY
InChI InChI=1S/C17H28O4/c1-14(2,3)13(19)20-9-10-17(8)11(12(18)21-10)15(4,5)16(17,6)7/h10-11H,9H2,1-8H3/t10-,11+,17-/m1/s1
InChIKey BSRTWBAJPDCJDG-VGTOOOLASA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 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 2U9lcXFap9I
Name (1S,4S,5R)-5-Methyl-4-pivaloyloxymethyl-6,6,7,7-tetramethyl-3-oxabicyclo[3.2.0]heptan-2-one
Alternate Name(s) [(1R,2S,5S)-1,6,6,7,7-pentamethyl-4-oxo-3-oxabicyclo[3.2.0]hept-2-yl]methyl pivalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-14(2,3)13(19)20-9-10-17(8)11(12(18)21-10)15(4,5)16(17,6)7/h10-11H,9H2,1-8H3/t10-,11+,17-/m1/s1
InChIKey BSRTWBAJPDCJDG-VGTOOOLASA-N
Molecular Weight 296.407 g/mol
SMILES [C@]12([C@](C(=O)O[C@@]2(COC(C(C)(C)C)=O)[H])([H])C(C1(C)C)(C)C)C
SPLASH splash10-053u-9000000000-a6b3cfe96053a37dd487
Source of Spectrum F-52-1275-18
Wiley ID 794897