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Methyl 3-oxo-cycloheptane-1-carboxylate
SpectraBase Compound ID A9y1MYeDfIk
InChI InChI=1S/C9H14O3/c1-12-9(11)7-4-2-3-5-8(10)6-7/h7H,2-6H2,1H3
InChIKey KNOYEWHQWMVNPM-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5l51IRI3MKy
Name 1-Cycloheptanone-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-12-9(11)7-4-2-3-5-8(10)6-7/h7H,2-6H2,1H3
InChIKey KNOYEWHQWMVNPM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19721050439
Molecular Weight 170.208 g/mol
SMILES C1C(CC(CCC1)C(=O)OC)=O
SPLASH splash10-0a4i-5900000000-9994d36855e4104aaa2b
Source of Spectrum K-105-1462-5
Synonyms Methyl 3-oxocycloheptane-1-carboxylate
Wiley ID 1794717