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2-Hydroxyl-2-(pyrrol-2-yl)-3,3,3-trifluoropropionic acid ethyl ester
SpectraBase Compound ID E7HXxf7s7Ko
InChI InChI=1S/C9H10F3NO3/c1-2-16-7(14)8(15,9(10,11)12)6-4-3-5-13-6/h3-5,13,15H,2H2,1H3
InChIKey ZOQFCCWJBVOJKD-UHFFFAOYSA-N
Mol Weight 237.18 g/mol
Molecular Formula C9H10F3NO3
Exact Mass 237.061278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JZHa2rgX6UR
Name 2-Hydroxyl-2-(pyrrol-2-yl)-3,3,3-trifluoropropionic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10F3NO3
InChI InChI=1S/C9H10F3NO3/c1-2-16-7(14)8(15,9(10,11)12)6-4-3-5-13-6/h3-5,13,15H,2H2,1H3
InChIKey ZOQFCCWJBVOJKD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201100569
Molecular Weight 237.178 g/mol
SMILES OC(c1ccc[nH]1)(C(F)(F)F)C(=O)OCC
SPLASH splash10-01ox-9720000000-587469305c225373dbf3
Source of Spectrum CMC-7-910/SM9-35
Synonyms Ethyl 3,3,3-trifluoro-2-hydroxy-2-(1H-pyrrol-2-yl)propanoate 3,3,3-trifluoro-2-hydroxy-2-(1H-pyrrol-2-yl)propanoic acid ethyl ester Ethyl 3,3,3-tris(fluoranyl)-2-oxidanyl-2-(1H-pyrrol-2-yl)propanoate
Wiley ID 1771811