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1H-Indene-2-butanoic acid, 2,3-dihydro-1-oxo-
SpectraBase Compound ID HdnNQw4z4t7
InChI InChI=1S/C13H14O3/c14-12(15)7-3-5-10-8-9-4-1-2-6-11(9)13(10)16/h1-2,4,6,10H,3,5,7-8H2,(H,14,15)
InChIKey PNCFPHBTSVKZDB-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 KTcKN9eygLv
Name 1H-Indene-2-butanoic acid, 2,3-dihydro-1-oxo-
Alternate Name(s) 4-(3-oxo-1,2-dihydroinden-2-yl)butanoic acid 4-(1-oxoindan-2-yl)butanoic acid 4-(3-oxidanylidene-1,2-dihydroinden-2-yl)butanoic acid
CAS Registry Number 61601-27-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c14-12(15)7-3-5-10-8-9-4-1-2-6-11(9)13(10)16/h1-2,4,6,10H,3,5,7-8H2,(H,14,15)
InChIKey PNCFPHBTSVKZDB-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES OC(CCCC1C(c2c(cccc2)C1)=O)=O
SPLASH splash10-001i-0900000000-482d6e3d06fa23fe8336
Source of Spectrum AH-120-619-32
Wiley ID 1217748