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8-Methoxycarbonyl-2,3,6,7-tetrahydro-4,5-benzotropo-7-one
SpectraBase Compound ID Csxbr4Tho0j
InChI InChI=1S/C13H14O3/c1-16-13(15)11-8-10-5-3-2-4-9(10)6-7-12(11)14/h2-5,11H,6-8H2,1H3
InChIKey ONUVEJMVGVABAV-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3QG2zOAIkM
Name 8-Methoxycarbonyl-2,3,6,7-tetrahydro-4,5-benzotropo-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-16-13(15)11-8-10-5-3-2-4-9(10)6-7-12(11)14/h2-5,11H,6-8H2,1H3
InChIKey ONUVEJMVGVABAV-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES C1(Cc2c(cccc2)CCC1=O)C(=O)OC
SPLASH splash10-0159-0920000000-313f261c42faa5a3c636
Source of Spectrum F-69-3423-6
Synonyms 2-Methoxycarbonyl-2,3,6,7-tetrahydro-4,5-benzotropone Methyl 7-oxo-6,7,8,9-tetrahydro-5H-benzo[a]cycloheptene-6-carboxylate
Wiley ID 1595041