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1-Hepten-3-one, 2-methyl-
SpectraBase Compound ID 9mYZFeSDgxU
InChI InChI=1S/C8H14O/c1-4-5-6-8(9)7(2)3/h2,4-6H2,1,3H3
InChIKey LXSZBHUGHMTGQC-UHFFFAOYSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYdJ9MYGKyT
Name 1-Hepten-3-one, 2-methyl-
Alternate Name(s) 2-Methyl-1-hepten-3-one 2-Methylhept-1-en-3-one
CAS Registry Number 5888-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-4-5-6-8(9)7(2)3/h2,4-6H2,1,3H3
InChIKey LXSZBHUGHMTGQC-UHFFFAOYSA-N
Molecular Weight 126.199 g/mol
SMILES C(C(=O)CCCC)(=C)C
SPLASH splash10-0006-9100000000-e75be7c5ff3ca0cf0796
Source of Spectrum F-46-4001-12
Wiley ID 1130265