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Propanoic acid, 3-(2,5-difluorophenyl)-, butyl ester

View entire compound with spectra: 2 MS (GC)

Propanoic acid, 3-(2,5-difluorophenyl)-, butyl ester
SpectraBase Compound ID IE3CC7DSTKT
InChI InChI=1S/C13H16F2O2/c1-2-3-8-17-13(16)7-4-10-9-11(14)5-6-12(10)15/h5-6,9H,2-4,7-8H2,1H3
InChIKey UIHKAMKXWWUDHU-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C13H16F2O2
Exact Mass 242.111836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dwd2nidYGRz
Name PROPIONIC ACID, 3-(2,5-DIFLUOROPHENYL)-, BUTYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16F2O2
InChI InChI=1S/C13H16F2O2/c1-2-3-8-17-13(16)7-4-10-9-11(14)5-6-12(10)15/h5-6,9H,2-4,7-8H2,1H3
InChIKey UIHKAMKXWWUDHU-UHFFFAOYSA-N
Molecular Weight 242.1114
SMILES c1c(CCC(OCCCC)=O)c(F)ccc1F
SPLASH splash10-0006-3900000000-bb1d115547feafe7f5f0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany