| SpectraBase Spectrum ID |
70c58ZxyG1z |
| Name |
(S)-5-(3-Iodophenyl)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15IN2 |
| InChI |
InChI=1S/C16H15IN2/c1-12-10-16(13-6-5-7-14(17)11-13)19(18-12)15-8-3-2-4-9-15/h2-9,11,16H,10H2,1H3/t16-/m0/s1 |
| InChIKey |
PEKJIILVTKXBPU-INIZCTEOSA-N |
| Molecular Weight |
362.214 g/mol |
| SMILES |
C1(=NN([C@@](C1)(c1cc(I)ccc1)[H])c1ccccc1)C |
| SPLASH |
splash10-08fr-0509000000-c5886d401b70908e85c7 |
| Source of Spectrum |
F4-42-2176-2h |
| Wiley ID |
1673944 |
