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4-Heptanone, 3-methyl-
SpectraBase Compound ID JhEwIO6O0JP
InChI InChI=1S/C8H16O/c1-4-6-8(9)7(3)5-2/h7H,4-6H2,1-3H3
InChIKey NHIMSNHOEAVUKE-UHFFFAOYSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLtOFFziD4p
Name 4-Heptanone, 3-methyl-
CAS Registry Number 15726-15-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-4-6-8(9)7(3)5-2/h7H,4-6H2,1-3H3
InChIKey NHIMSNHOEAVUKE-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CC(CC)C(=O)CCC
SPLASH splash10-0596-9000000000-2acedf24a4c62477bea1
Source of Spectrum JZ-1992-921-0
Synonyms 3-Methyl-4-heptanone 3-Methylheptan-4-one EINECS 239-820-0
Wiley ID 1131620