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Methyl 1-methyl-2-oxo-cycloheptane-1-carboxylate
SpectraBase Compound ID I0Udc8YRTGy
InChI InChI=1S/C10H16O3/c1-10(9(12)13-2)7-5-3-4-6-8(10)11/h3-7H2,1-2H3
InChIKey LINNEBFALAZOBA-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1OXR7afAhM
Name 1-Methyl-2-oxo-1-cycloheptanecarboxylic acid methyl ester
CAS Registry Number 68081-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-10(9(12)13-2)7-5-3-4-6-8(10)11/h3-7H2,1-2H3
InChIKey LINNEBFALAZOBA-UHFFFAOYSA-N
Molecular Weight 184.235 g/mol
SMILES C1(C(=O)OC)(C(=O)CCCCC1)C
SPLASH splash10-0umi-0900000000-91dc6ec472169582ca70
Source of Spectrum C-110-2571-37
Synonyms 2-keto-1-methyl-cycloheptanecarboxylic acid methyl ester Methyl 1-methyl-2-oxidanylidene-cycloheptane-1-carboxylate Methyl 1-methyl-2-oxo-cycloheptanecarboxylate Methyl 1-methyl-2-oxocycloheptane-1-carboxylate
Wiley ID 1180593