| SpectraBase Spectrum ID |
BH9JeJOrVGg |
| Name |
(2RS,1'SR)-2-(1-Phenylethyl)but-3-enonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13N |
| InChI |
InChI=1S/C12H13N/c1-3-11(9-13)10(2)12-7-5-4-6-8-12/h3-8,10-11H,1H2,2H3 |
| InChIKey |
DUDVXNBRFSPYFD-UHFFFAOYSA-N |
| Molecular Weight |
171.243 g/mol |
| SMILES |
C(#N)C(C(c1ccccc1)C)C=C |
| SPLASH |
splash10-0a4i-0900000000-0819fdeb461ff4554417 |
| Source of Spectrum |
KC-1992-3271-12 |
| Synonyms |
2-(1-phenylethyl)-3-butenenitrile |
| Wiley ID |
777553 |
