| SpectraBase Spectrum ID |
1PMrXt86hW9 |
| Name |
2-[(phenylmethyl)-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12F3NO3 |
| InChI |
InChI=1S/C13H12F3NO3/c14-13(15,16)11(18)6-7-17(9-12(19)20)8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,19,20)/b7-6+ |
| InChIKey |
GWYIPTHWSHVEHU-VOTSOKGWSA-N |
| Molecular Weight |
287.238 g/mol |
| SMILES |
OC(CN(\C=C\C(C(F)(F)F)=O)Cc1ccccc1)=O |
| SPLASH |
splash10-000f-0090000000-161aad8ce8a4c4d76f8e |
| Source of Spectrum |
F-56-7270-5 |
| Synonyms |
2-[(phenylmethyl)-[(E)-4,4,4-tris(fluoranyl)-3-oxidanylidene-but-1-enyl]amino]ethanoic acid
2-[benzyl-[(E)-4,4,4-trifluoro-3-keto-but-1-enyl]amino]acetic acid
2-[benzyl-[(E)-4,4,4-trifluoro-3-oxo-but-1-enyl]amino]acetic acid |
| Wiley ID |
858449 |
![2-[(phenylmethyl)-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid](/api/spectrum/1PMrXt86hW9/structure.png?h=300&w=458 "2-[(phenylmethyl)-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid")
