SpectraBase Spectrum ID |
3vnuIypjcKF |
Name |
7-(1-(4-Bromophenyl)vinyl)-3-(p-tolyl)-5-tosyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine |
Appearance |
Solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H25BrN4O2S |
InChI |
InChI=1S/C27H25BrN4O2S/c1-18-4-8-22(9-5-18)27-26-17-31(35(33,34)24-14-6-19(2)7-15-24)16-25(32(26)30-29-27)20(3)21-10-12-23(28)13-11-21/h4-15,25H,3,16-17H2,1-2H3 |
InChIKey |
KGCHOVPPYVDEBD-UHFFFAOYSA-N |
Instrument Name |
HP 5989A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/adsc.201901284 |
Molecular Weight |
549.487 g/mol |
SMILES |
c1(S(N2Cc3[n](C(C2)C(=C)c2ccc(cc2)Br)nnc3-c2ccc(cc2)C)(=O)=O)ccc(cc1)C |
SPLASH |
splash10-0006-9000000000-175c2e0750705e1ef362 |
Source of Spectrum |
ASC-362-639-5bf |
Wiley ID |
1838200 |