| SpectraBase Spectrum ID |
6akzOCqt8Lz |
| Name |
2,2,2-trifluoro-N-(2-(3-hydroxybut-1-ynyl)-4-methyl-6-nitrophenyl)acetamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H11F3N2O4 |
| InChI |
InChI=1S/C13H11F3N2O4/c1-7-5-9(4-3-8(2)19)11(10(6-7)18(21)22)17-12(20)13(14,15)16/h5-6,8,19H,1-2H3,(H,17,20) |
| InChIKey |
IPRGQKMIJPHKAO-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/adsc.201400881 |
| Molecular Weight |
316.236 g/mol |
| SMILES |
OC(C#Cc1cc(cc(c1NC(C(F)(F)F)=O)[N+](=O)[O-])C)C |
| SPLASH |
splash10-0006-9010000000-aeff12e55dc465d64992 |
| Source of Spectrum |
ASC-357-1053/SM6-1i |
| Synonyms |
2,2,2-trifluoro-N-(2-(3-hydroxybut-1-yn-1-yl)-4-methyl-6-nitrophenyl)acetamide |
| Wiley ID |
1770994 |
