SpectraBase Spectrum ID |
1H5OvSVmcLe |
Name |
DL-Leucine, N-[(5-phenyl-2-thiazolyl)methylene]-, methyl ester |
CAS Registry Number |
113370-72-2 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20N2O2S |
InChI |
InChI=1S/C17H20N2O2S/c1-12(2)9-14(17(20)21-3)18-11-16-19-10-15(22-16)13-7-5-4-6-8-13/h4-8,10-12,14H,9H2,1-3H3/b18-11+ |
InChIKey |
QBRVQUYNIIHQII-WOJGMQOQSA-N |
Molecular Weight |
316.419 g/mol |
SMILES |
c1(sc(nc1)\C=N\C(C(=O)OC)CC(C)C)-c1ccccc1 |
SPLASH |
splash10-0a4i-0093000000-858ca64dabee4e519e84 |
Source of Spectrum |
KC-1987-2292-6 |
Synonyms |
methyl 4-methyl-2-{[(E)-(5-phenyl-1,3-thiazol-2-yl)methylidene]amino}pentanoate
Methyl N-(2-phenylthiazol-5-ylmethylene)leucinate |
Wiley ID |
1316686 |