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

*Links on SpectraBase are not permalinks.
(4,4-2H2)-6-Methyl-6-hepten-2-one
SpectraBase Compound ID D6QLmfyxCeO
InChI InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h1,4-6H2,2-3H3/i4D2
InChIKey FMCHGBFGIKQNCT-APZFVMQVSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H12D2O
Exact Mass 128.117019 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 J0bqxl8BM4I
Name (4,4-2H2)-6-Methyl-6-hepten-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12D2O
InChI InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h1,4-6H2,2-3H3/i4D2
InChIKey FMCHGBFGIKQNCT-APZFVMQVSA-N
Molecular Weight 128.211 g/mol
SMILES C(=C)(CC(CC(=O)C)([D])[D])C
SPLASH splash10-014i-9000000000-efa7f1c6f089129bc6ac
Source of Spectrum G2-4-450-3-2H2
Wiley ID 1690288