| SpectraBase Spectrum ID |
1UXOU5J2mqh |
| Name |
Benzeneacetonitrile, .alpha.-(3-oxobutyl)-.alpha.-[(phenylmethylene)amino]- |
| CAS Registry Number |
113543-69-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18N2O |
| InChI |
InChI=1S/C19H18N2O/c1-16(22)12-13-19(15-20,18-10-6-3-7-11-18)21-14-17-8-4-2-5-9-17/h2-11,14H,12-13H2,1H3/b21-14+ |
| InChIKey |
CHPIOYYSPAVGPE-KGENOOAVSA-N |
| Molecular Weight |
290.366 g/mol |
| SMILES |
C(\N=C\c1ccccc1)(C#N)(CCC(=O)C)c1ccccc1 |
| SPLASH |
splash10-014l-0090000000-d53de1b1521f327a34d1 |
| Source of Spectrum |
AJ-60-3354-2 |
| Synonyms |
2-Benzylideneamino-2-phenyl-5-oxohexanenitrile
5-oxo-2-phenyl-2-{[(E)-phenylmethylidene]amino}hexanenitrile |
| Wiley ID |
1293961 |
![Benzeneacetonitrile, .alpha.-(3-oxobutyl)-.alpha.-[(phenylmethylene)amino]-](/api/spectrum/1UXOU5J2mqh/structure.png?h=300&w=458 "Benzeneacetonitrile, .alpha.-(3-oxobutyl)-.alpha.-[(phenylmethylene)amino]-")
