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

*Links on SpectraBase are not permalinks.
4,6-Heptadien-2-one, 3,6-dimethyl-3-(1-methylethyl)-, (E)-
SpectraBase Compound ID DB9suha2nTG
InChI InChI=1S/C12H20O/c1-9(2)7-8-12(6,10(3)4)11(5)13/h7-8,10H,1H2,2-6H3/b8-7+
InChIKey RMSZYGYQWJELER-BQYQJAHWSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 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 6rBIphsLQwP
Name 4,6-Heptadien-2-one, 3,6-dimethyl-3-(1-methylethyl)-, (E)-
CAS Registry Number 77822-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-9(2)7-8-12(6,10(3)4)11(5)13/h7-8,10H,1H2,2-6H3/b8-7+
InChIKey RMSZYGYQWJELER-BQYQJAHWSA-N
Molecular Weight 180.291 g/mol
SMILES C(=O)(C(C(C)C)(C)\C=C\C(C)=C)C
SPLASH splash10-052v-9400000000-bd0ca5e19ce890204a8b
Synonyms (4E)-3-Isopropyl-3,6-dimethyl-4,6-heptadien-2-one (4E)-3,6-dimethyl-3-propan-2-yl-2-hepta-4,6-dienone (4E)-3,6-dimethyl-3-propan-2-yl-hepta-4,6-dien-2-one (4E)-3-isopropyl-3,6-dimethyl-hepta-4,6-dien-2-one
Wiley ID 1488915