SpectraBase Spectrum ID |
BzvFX09GnKa |
Name |
[2',3',4',4'-2H4]dimethyl {p-trifluoroacetamido]benzoyl}-L-glutamate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H13D4F3N2O6 |
InChI |
InChI=1S/C16H17F3N2O6/c1-26-12(22)8-7-11(14(24)27-2)21-13(23)9-3-5-10(6-4-9)20-15(25)16(17,18)19/h3-6,11H,7-8H2,1-2H3,(H,20,25)(H,21,23)/t11-/m0/s1/i7D2,8D2 |
InChIKey |
RXRWKOBMLFNNBA-QCSVEXGJSA-N |
Molecular Weight |
394.340 g/mol |
SMILES |
N([C@@](C(C(C(=O)OC)([D])[D])([D])[D])(C(=O)OC)[H])C(c1ccc(NC(C(F)(F)F)=O)cc1)=O |
SPLASH |
splash10-014i-0091000000-353f8fffafc9d4eb973f |
Source of Spectrum |
KC-0-1321-29 |
Synonyms |
[3',3',4',4'-2H4]dimethyl-{p-trifluoroacetamido]-benzoyl}-L-glutamate
(4S)-2,2,3,3-tetradeuterio-4-[[oxo-[4-[(2,2,2-trifluoro-1-oxoethyl)amino]phenyl]methyl]amino]pentanedioic acid dimethyl ester
Dimethyl (4S)-2,2,3,3-tetradeuterio-4-[[4-[(2,2,2-trifluoroacetyl)amino]benzoyl]amino]pentanedioate
Dimethyl (4S)-2,2,3,3-tetradeuterio-4-[[4-[2,2,2-tris(fluoranyl)ethanoylamino]phenyl]carbonylamino]pentanedioate |
Wiley ID |
827973 |