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2H-Pyrrole-3-carboxylic acid, 2-ethyl-3,4-dihydro-5-phenyl-, methyl ester, cis-
SpectraBase Compound ID Ax1EZbGfjRw
InChI InChI=1S/C14H17NO2/c1-3-12-11(14(16)17-2)9-13(15-12)10-7-5-4-6-8-10/h4-8,11-12H,3,9H2,1-2H3/t11-,12-/m1/s1
InChIKey DUSYLALIIZPQHE-VXGBXAGGSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxEWATSCZoX
Name 2H-Pyrrole-3-carboxylic acid, 2-ethyl-3,4-dihydro-5-phenyl-, methyl ester, cis-
CAS Registry Number 113298-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-3-12-11(14(16)17-2)9-13(15-12)10-7-5-4-6-8-10/h4-8,11-12H,3,9H2,1-2H3/t11-,12-/m1/s1
InChIKey DUSYLALIIZPQHE-VXGBXAGGSA-N
Molecular Weight 231.295 g/mol
SMILES C1(=N[C@@]([C@@](C1)(C(=O)OC)[H])(CC)[H])c1ccccc1
SPLASH splash10-0gc0-2900000000-81f77380226e5305375f
Source of Spectrum AJ-60-3364-2
Synonyms 4-Methoxycarbonyl-2-phenyl-5-ethyl-1-pyrroline Methyl (2R,3R)-2-ethyl-5-phenyl-3,4-dihydro-2H-pyrrole-3-carboxylate
Wiley ID 1232926