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2,2-Propanediol, 3-(1,3-dimethyl-1H-indol-2-yl)-1,1,1-trifluoro-
SpectraBase Compound ID 7hiK7Q1ahtZ
InChI InChI=1S/C13H14F3NO2/c1-8-9-5-3-4-6-10(9)17(2)11(8)7-12(18,19)13(14,15)16/h3-6,18-19H,7H2,1-2H3
InChIKey SRAFCPQACISVMJ-UHFFFAOYSA-N
Mol Weight 273.26 g/mol
Molecular Formula C13H14F3NO2
Exact Mass 273.097663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gvkb2QOE4yZ
Name 2,2-Propanediol, 3-(1,3-dimethyl-1H-indol-2-yl)-1,1,1-trifluoro-
Alternate Name(s) 1,3-Dimethyl-3-trifluoroacetyl-2-trifluoroacetylmethyleneindoline hydrate 3-(1,3-dimethyl-1H-indol-2-yl)-1,1,1-trifluoro-2,2-propanediol
CAS Registry Number 77436-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F3NO2
InChI InChI=1S/C13H14F3NO2/c1-8-9-5-3-4-6-10(9)17(2)11(8)7-12(18,19)13(14,15)16/h3-6,18-19H,7H2,1-2H3
InChIKey SRAFCPQACISVMJ-UHFFFAOYSA-N
Molecular Weight 273.255 g/mol
SMILES OC(Cc1[n](c2ccccc2c1C)C)(C(F)(F)F)O
SPLASH splash10-0a4i-0940000000-4df4198fea382dd3fb38
Source of Spectrum KC-1981-387-0
Wiley ID 1277086