| SpectraBase Spectrum ID |
2Z4OenOQmMf |
| Name |
2-Acetoxy-3-methyl-2-phenylbutylmalonitrile |
| Alternate Name(s) |
3,3-dicyano-1-isopropyl-1-phenylpropyl acetate
acetic acid (1,1-dicyano-4-methyl-2-phenylpentan-3-yl) ester
(1,1-dicyano-4-methyl-2-phenylpentan-3-yl) acetate
(3,3-dicyano-1-isopropyl-2-phenyl-propyl) acetate
(1,1-dicyano-4-methyl-2-phenyl-pentan-3-yl) ethanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N2O2 |
| InChI |
InChI=1S/C16H18N2O2/c1-11(2)16(20-12(3)19)15(14(9-17)10-18)13-7-5-4-6-8-13/h4-8,11,14-16H,1-3H3 |
| InChIKey |
PJGBFIWOFWXESH-UHFFFAOYSA-N |
| Molecular Weight |
270.332 g/mol |
| SMILES |
C(C(C(C#N)C#N)c1ccccc1)(OC(=O)C)C(C)C |
| SPLASH |
splash10-0006-9000000000-9c6bec9272a008816377 |
| Source of Spectrum |
J-58-596-20 |
| Wiley ID |
1274446 |
