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(S)-1-(1-Phenylethyl)pyrrole-2-carboxylic acid
SpectraBase Compound ID 8iFFI0j0vBb
InChI InChI=1S/C13H13NO2/c1-10(11-6-3-2-4-7-11)14-9-5-8-12(14)13(15)16/h2-10H,1H3,(H,15,16)/t10-/m0/s1
InChIKey BFLKSSGFEWKBMW-JTQLQIEISA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6w2ggpmNlH
Name (S)-1-(1-Phenylethyl)pyrrole-2-carboxylic acid
Alternate Name(s) 1-[(1S)-1-phenylethyl]-1H-pyrrole-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-10(11-6-3-2-4-7-11)14-9-5-8-12(14)13(15)16/h2-10H,1H3,(H,15,16)/t10-/m0/s1
InChIKey BFLKSSGFEWKBMW-JTQLQIEISA-N
Molecular Weight 215.252 g/mol
SMILES OC(c1[n]([C@](c2ccccc2)(C)[H])ccc1)=O
SPLASH splash10-0a4i-1900000000-20bdf6a13600355f4d39
Source of Spectrum KD-14-808-0
Wiley ID 1635933