| SpectraBase Spectrum ID |
LCakj8BXo3v |
| Name |
trans-2,2-Dimethyl-3-(2-methyl-1-propenyl)-1-(phenylthio)cyclopropane-1-carbonitrile |
| CAS Registry Number |
78715-31-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NS |
| InChI |
InChI=1S/C16H19NS/c1-12(2)10-14-15(3,4)16(14,11-17)18-13-8-6-5-7-9-13/h5-10,14H,1-4H3/t14-,16-/m0/s1 |
| InChIKey |
AFVWYGVXGJEWFS-HOCLYGCPSA-N |
| Molecular Weight |
257.395 g/mol |
| SMILES |
[C@@]1([C@@](C=C(C)C)(C1(C)C)[H])(C#N)Sc1ccccc1 |
| SPLASH |
splash10-0002-0900000000-27aaaf9217eacde4661d |
| Source of Spectrum |
J-46-4336-0 |
| Synonyms |
(1S,3S)-2,2-dimethyl-3-(2-methyl-1-propenyl)-1-(phenylsulfanyl)cyclopropanecarbonitrile |
| Wiley ID |
1260978 |
