For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-Imidazole-5-carboxylic acid, 4,5-dihydro-4-methyl-1-(1-methylethyl)-2-phenyl-, ethyl ester, trans-
SpectraBase Compound ID 1E3kSeEWVrm
InChI InChI=1S/C16H22N2O2/c1-5-20-16(19)14-12(4)17-15(18(14)11(2)3)13-9-7-6-8-10-13/h6-12,14H,5H2,1-4H3/t12-,14+/m1/s1
InChIKey LUIGKXPWBNAGTR-OCCSQVGLSA-N
Mol Weight 274.36 g/mol
Molecular Formula C16H22N2O2
Exact Mass 274.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IWIsDtZMYoz
Name 1H-Imidazole-5-carboxylic acid, 4,5-dihydro-4-methyl-1-(1-methylethyl)-2-phenyl-, ethyl ester, trans-
CAS Registry Number 97938-73-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O2
InChI InChI=1S/C16H22N2O2/c1-5-20-16(19)14-12(4)17-15(18(14)11(2)3)13-9-7-6-8-10-13/h6-12,14H,5H2,1-4H3/t12-,14+/m1/s1
InChIKey LUIGKXPWBNAGTR-OCCSQVGLSA-N
Molecular Weight 274.364 g/mol
SMILES C=1(N([C@](C(=O)OCC)([C@](N1)(C)[H])[H])C(C)C)c1ccccc1
SPLASH splash10-0zfr-0690000000-82ddb401c1c94f79f747
Source of Spectrum O-20-264-6
Synonyms 1n-isopropyl-2-phenyl-4-methyl-5-ethoxycarbonyl-2-imidazoline(trans) Ethyl (4R,5S)-1-isopropyl-4-methyl-2-phenyl-4,5-dihydro-1H-imidazole-5-carboxylate trans-1-isopropyl-2-phenyl-4-methyl-5-ethoxycarbonyl-2-imidazoline
Wiley ID 1278314