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6-Heptenoic acid, 3-oxo-, methyl ester
SpectraBase Compound ID 9pyRzPeeSlY
InChI InChI=1S/C8H12O3/c1-3-4-5-7(9)6-8(10)11-2/h3H,1,4-6H2,2H3
InChIKey HQLSDJWYINRSAP-UHFFFAOYSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2sdNkyL1du
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-3-4-5-7(9)6-8(10)11-2/h3H,1,4-6H2,2H3
InChIKey HQLSDJWYINRSAP-UHFFFAOYSA-N
Molecular Weight 156.0783
SMILES C=CCCC(CC(OC)=O)=O
SPLASH splash10-0pc0-9100000000-2b5b032f5d90c5b8c788
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany