| SpectraBase Spectrum ID |
LtJnQxSeJnU |
| Name |
1,3,4,5-Tetraphenyl-.delta.2-pyrazolin (trans) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.178298716 u |
| Formula |
C27H22N2 |
| InChI |
InChI=1S/C27H22N2/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)28-29(24-19-11-4-12-20-24)27(25)23-17-9-3-10-18-23/h1-20,25,27H/t25-,27+/m1/s1 |
| InChIKey |
PAIKLRCZBDBOTL-VPUSJEBWSA-N |
| Molecular Weight |
374.487 g/mol |
| SMILES |
[C@@]1(N(N=C([C@]1(C1=CC=CC=C1)[H])C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977018 |
