| SpectraBase Spectrum ID |
InvoRO48svm |
| Name |
Cyclopropanecarboxylic acid, 3-(4-chlorophenyl)-1-cyano-2-methyl-2-phenyl-, methyl ester, (1.alpha.,2.beta.,3.beta.)- |
| CAS Registry Number |
117918-89-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16ClNO2 |
| InChI |
InChI=1S/C19H16ClNO2/c1-18(14-6-4-3-5-7-14)16(13-8-10-15(20)11-9-13)19(18,12-21)17(22)23-2/h3-11,16H,1-2H3/t16-,18+,19-/m1/s1 |
| InChIKey |
JSEIYNACEVUZRU-NZSAHSFTSA-N |
| Molecular Weight |
325.795 g/mol |
| SMILES |
[C@@]1([C@](c2ccccc2)(C)[C@]1(c1ccc(cc1)Cl)[H])(C(=O)OC)C#N |
| SPLASH |
splash10-0fb9-0079000000-a7dd9032ddc03dac879c |
| Source of Spectrum |
J-54-638-0 |
| Synonyms |
methyl (1S,2R,3R)-3-(4-chlorophenyl)-1-cyano-2-methyl-2-phenylcyclopropanecarboxylate |
| Wiley ID |
1324005 |
