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1H-Pyrrole-3-carboxylic acid, 2,3-dihydro-5-methyl-2-phenyl-, methyl ester, cis-
SpectraBase Compound ID 7k4EmmDzW9f
InChI InChI=1S/C13H15NO2/c1-9-8-11(13(15)16-2)12(14-9)10-6-4-3-5-7-10/h3-8,11-12,14H,1-2H3/t11-,12-/m1/s1
InChIKey YKRYYZKRQAKKHM-VXGBXAGGSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3SEf5CtPnM
Name 1H-Pyrrole-3-carboxylic acid, 2,3-dihydro-5-methyl-2-phenyl-, methyl ester, cis-
Alternate Name(s) 4-Methoxycarbonyl-2-methyl-5-phenyl-1-pyrroline Methyl (2S,3R)-5-methyl-2-phenyl-2,3-dihydro-1H-pyrrole-3-carboxylate
CAS Registry Number 113298-18-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-9-8-11(13(15)16-2)12(14-9)10-6-4-3-5-7-10/h3-8,11-12,14H,1-2H3/t11-,12-/m1/s1
InChIKey YKRYYZKRQAKKHM-VXGBXAGGSA-N
Molecular Weight 217.268 g/mol
SMILES N1C(=C[C@]([C@]1(c1ccccc1)[H])(C(=O)OC)[H])C
SPLASH splash10-053l-9600000000-eeff26cfc2846cae2816
Source of Spectrum AJ-60-3364-2
Wiley ID 1216683