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

*Links on SpectraBase are not permalinks.
Phenyl 2,2,3-trideuterioheptanoate
SpectraBase Compound ID LxBCjwjPGl
InChI InChI=1S/C13H18O2/c1-2-3-4-8-11-13(14)15-12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3/i8D,11D2
InChIKey USVUMWSMZMQXIZ-HSIWBWHDSA-N
Mol Weight 209.3 g/mol
Molecular Formula C13H152D3O2
Exact Mass 209.14951 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 3BNHAsamHpo
Name Phenyl 2,2,3-trideuterioheptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15D3O2
InChI InChI=1S/C13H18O2/c1-2-3-4-8-11-13(14)15-12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3/i8D,11D2
InChIKey USVUMWSMZMQXIZ-HSIWBWHDSA-N
Molecular Weight 209.303 g/mol
SMILES C(C(C(CCCC)[2D])([2D])[2D])(=O)Oc1ccccc1
SPLASH splash10-014j-9410000000-f9b0b4b43e92f2914337
Source of Spectrum F-70-4719-9
Synonyms 2,2,3-trideuterioenanthic acid phenyl ester 2,2,3-trideuterioheptanoic acid phenyl ester
Wiley ID 1597051