SpectraBase Spectrum ID |
2ByYNqUVJ42 |
Name |
(E)-7-(1-(4-bromophenyl)pent-1-en-1-yl)-3-phenyl-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 |
C29H29BrN4O2S |
InChI |
InChI=1S/C29H29BrN4O2S/c1-3-4-10-26(22-13-15-24(30)16-14-22)27-19-33(37(35,36)25-17-11-21(2)12-18-25)20-28-29(31-32-34(27)28)23-8-6-5-7-9-23/h5-18,27H,3-4,19-20H2,1-2H3/b26-10+ |
InChIKey |
MRZCLDCKDFRBCB-NSKAYECMSA-N |
Instrument Name |
HP 5989A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/adsc.201901284 |
Molecular Weight |
577.541 g/mol |
Reported Formula |
C29H29N4O2SBr |
SMILES |
c1(S(N2Cc3[n](C(C2)\C(=C\CCC)c2ccc(cc2)Br)nnc3-c2ccccc2)(=O)=O)ccc(cc1)C |
SPLASH |
splash10-0006-9000000000-175c2e0750705e1ef362 |
Source of Spectrum |
ASC-362-643-E-5kf |
Wiley ID |
1838206 |