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5-Hepten-2-one, 3-methylene-
SpectraBase Compound ID 5r6daDRNwDB
InChI InChI=1S/C8H12O/c1-4-5-6-7(2)8(3)9/h4-5H,2,6H2,1,3H3/b5-4+
InChIKey LUYGQJFYHOUMIY-SNAWJCMRSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pajvsmuSlL
Name 5-Hepten-2-one, 3-methylene-
Alternate Name(s) (5E)-3-methylene-5-hepten-2-one 3-Methylene-5-hepten-2-one 3-Methylene-6-hepten-2-one
CAS Registry Number 20521-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-4-5-6-7(2)8(3)9/h4-5H,2,6H2,1,3H3/b5-4+
InChIKey LUYGQJFYHOUMIY-SNAWJCMRSA-N
Molecular Weight 124.183 g/mol
SMILES C(C(=O)C)(=C)C\C=C\C
SPLASH splash10-0a59-9600000000-5ca775fe5471218888f7
Source of Spectrum O-24-646-8
Wiley ID 1129059