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2-Chloro-1-oxo-indan-2-carboxylic acid isopropyl ester
SpectraBase Compound ID GfAnHUm0pev
InChI InChI=1S/C13H13ClO3/c1-8(2)17-12(16)13(14)7-9-5-3-4-6-10(9)11(13)15/h3-6,8H,7H2,1-2H3
InChIKey SQJOCCVCDSJTIC-UHFFFAOYSA-N
Mol Weight 252.7 g/mol
Molecular Formula C13H13ClO3
Exact Mass 252.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tJt4pWMqf8
Name 2-Chloro-1-oxo-indan-2-carboxylic acid isopropyl ester
Alternate Name(s) Iso-Propyl 2-chloro-1-oxo-indan-2-carboxylate Isopropyl 2-chloro-1-oxo-2,3-dihydro-1H-indene-2-carboxylate
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Formula C13H13ClO3
InChI InChI=1S/C13H13ClO3/c1-8(2)17-12(16)13(14)7-9-5-3-4-6-10(9)11(13)15/h3-6,8H,7H2,1-2H3
InChIKey SQJOCCVCDSJTIC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200088
Molecular Weight 252.697 g/mol
SMILES c1cc2C(C(Cc2cc1)(C(OC(C)C)=O)Cl)=O
SPLASH splash10-0691-1910000000-e29178a0cd500114fd23
Source of Spectrum ASC-354-1980/SM9-(_)_3c
Wiley ID 1764868