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1H-Imidazole-5-carboxylic acid, 4,5-dihydro-1,4-dimethyl-2-phenyl-, ethyl ester, trans-
SpectraBase Compound ID AWY1mNSL8NX
InChI InChI=1S/C14H18N2O2/c1-4-18-14(17)12-10(2)15-13(16(12)3)11-8-6-5-7-9-11/h5-10,12H,4H2,1-3H3/t10-,12+/m1/s1
InChIKey BLKTYYYNCBQJHB-PWSUYJOCSA-N
Mol Weight 246.31 g/mol
Molecular Formula C14H18N2O2
Exact Mass 246.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gh2nkHs9O54
Name 1H-Imidazole-5-carboxylic acid, 4,5-dihydro-1,4-dimethyl-2-phenyl-, ethyl ester, trans-
CAS Registry Number 97938-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2O2
InChI InChI=1S/C14H18N2O2/c1-4-18-14(17)12-10(2)15-13(16(12)3)11-8-6-5-7-9-11/h5-10,12H,4H2,1-3H3/t10-,12+/m1/s1
InChIKey BLKTYYYNCBQJHB-PWSUYJOCSA-N
Molecular Weight 246.310 g/mol
SMILES C=1(N([C@@]([C@](N1)(C)[H])(C(=O)OCC)[H])C)c1ccccc1
SPLASH splash10-0a4i-0900000000-fd00350e4f03d42f3453
Source of Spectrum O-20-264-5
Synonyms 1N-methyl-2-phenyl-4-methyl-5-ethoxycarbonyl-1H-imidazoline(trans) Ethyl (4R,5S)-1,4-dimethyl-2-phenyl-4,5-dihydro-1H-imidazole-5-carboxylate trans-1,4-dimethyl-2-phenyl-5-ethoxycarbonyl-2-imidazoline
Wiley ID 1249053