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4-ketotetralin-1-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

4-ketotetralin-1-carboxylic acid methyl ester
SpectraBase Compound ID Ayqa63FYeaf
InChI InChI=1S/C12H12O3/c1-15-12(14)10-6-7-11(13)9-5-3-2-4-8(9)10/h2-5,10H,6-7H2,1H3
InChIKey FJXPXNBKKZUONN-UHFFFAOYSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmaXUL0tDyt
Name 4-ketotetralin-1-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-15-12(14)10-6-7-11(13)9-5-3-2-4-8(9)10/h2-5,10H,6-7H2,1H3
InChIKey FJXPXNBKKZUONN-UHFFFAOYSA-N
Molecular Weight 204.225 g/mol
SMILES c12C(C(=O)OC)CCC(c2cccc1)=O
SPLASH splash10-002b-0900000000-1db50274d60585d56f26
Source of Spectrum J-59-3746-3
Synonyms 4-Oxo-2,3-dihydro-1H-naphthalene-1-carboxylic acid methyl ester Methyl 4-oxidanylidene-2,3-dihydro-1H-naphthalene-1-carboxylate Methyl 4-oxo-2,3-dihydro-1H-naphthalene-1-carboxylate Methyl 4-oxotetralin-1-carboxylate
Wiley ID 1201861