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N-(2-Hydroxymethylphenyl)-5-phenylthio-2-trifluoroacetylpyrrole
SpectraBase Compound ID 6am5s5TtBuK
InChI InChI=1S/C19H14F3NO2S/c20-19(21,22)18(25)16-10-11-17(26-14-7-2-1-3-8-14)23(16)15-9-5-4-6-13(15)12-24/h1-11,24H,12H2
InChIKey SAOJKXVNLFMHRP-UHFFFAOYSA-N
Mol Weight 377.38 g/mol
Molecular Formula C19H14F3NO2S
Exact Mass 377.069734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pcD3zQ41Ms
Name N-(2-Hydroxymethylphenyl)-5-phenylthio-2-trifluoroacetylpyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14F3NO2S
InChI InChI=1S/C19H14F3NO2S/c20-19(21,22)18(25)16-10-11-17(26-14-7-2-1-3-8-14)23(16)15-9-5-4-6-13(15)12-24/h1-11,24H,12H2
InChIKey SAOJKXVNLFMHRP-UHFFFAOYSA-N
Molecular Weight 377.381 g/mol
SMILES OCc1c(-[n]2c(C(C(F)(F)F)=O)ccc2Sc2ccccc2)cccc1
SPLASH splash10-0udi-9300000000-3113fbaf7d73639b62fd
Source of Spectrum H1-38-1784-6
Synonyms 2,2,2-trifluoro-1-[1-[2-(hydroxymethyl)phenyl]-5-(phenylsulfanyl)-1H-pyrrol-2-yl]ethanone
Wiley ID 756541