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

*Links on SpectraBase are not permalinks.

Ethyl (2E,4R,5S)-7-Methyl[4,5-D2]octa-2,6-dienoate

View entire compound with spectra: 1 MS (GC)

Ethyl (2E,4R,5S)-7-Methyl[4,5-D2]octa-2,6-dienoate
SpectraBase Compound ID BCtA72M1zgo
InChI InChI=1S/C11H18O2/c1-4-13-11(12)9-7-5-6-8-10(2)3/h7-9H,4-6H2,1-3H3/b9-7+/i5D,6D/t5-,6-/m0/s1
InChIKey LSVFMHBIUBAQTM-BYFIWEGJSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H162D2O2
Exact Mass 184.143233 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 17tLsIfKcgi
Name Ethyl (2E,4R,5S)-7-Methyl[4,5-D2]octa-2,6-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16D2O2
InChI InChI=1S/C11H18O2/c1-4-13-11(12)9-7-5-6-8-10(2)3/h7-9H,4-6H2,1-3H3/b9-7+/i5D,6D/t5-,6-/m0/s1
InChIKey LSVFMHBIUBAQTM-BYFIWEGJSA-N
Molecular Weight 184.275 g/mol
SMILES C(\C=C\[C@]([C@@](C=C(C)C)([2D])[H])([2D])[H])(=O)OCC
SPLASH splash10-00di-9500000000-5bd74bfe5b238bf8408e
Source of Spectrum F-50-6871-20
Wiley ID 1178967