| SpectraBase Spectrum ID |
9FGajWaboqg |
| Name |
trans-7-(1-(4-bromophenyl)vinyl)-4-methyl-3-phenyl-5-tosyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine |
| Appearance |
Oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H25BrN4O2S |
| InChI |
InChI=1S/C27H25BrN4O2S/c1-18-9-15-24(16-10-18)35(33,34)31-17-25(19(2)21-11-13-23(28)14-12-21)32-27(20(31)3)26(29-30-32)22-7-5-4-6-8-22/h4-16,20,25H,2,17H2,1,3H3/t20-,25-/m0/s1 |
| InChIKey |
NCGLZKLCUGAJFH-CPJSRVTESA-N |
| Instrument Name |
HP 5989A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.201901284 |
| Molecular Weight |
549.487 g/mol |
| Reported Formula |
C27H25BrN4O2S |
| SMILES |
c1(S(N2[C@](c3[n]([C@@](C2)(C(=C)c2ccc(cc2)Br)[H])nnc3-c2ccccc2)(C)[H])(=O)=O)ccc(cc1)C |
| SPLASH |
splash10-0a4i-9000000000-f3644ddde874671631bf |
| Source of Spectrum |
ASC-362-643-trans-5lf |
| Wiley ID |
1838208 |
![trans-7-(1-(4-bromophenyl)vinyl)-4-methyl-3-phenyl-5-tosyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine](/api/spectrum/9FGajWaboqg/structure.png?h=300&w=458 "trans-7-(1-(4-bromophenyl)vinyl)-4-methyl-3-phenyl-5-tosyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine")
