| SpectraBase Spectrum ID |
JUEwpQCdO3I |
| Name |
Hexanoic acid, 2-cyano-2-hydroxy-, ethyl ester, benzoate (ester) |
| Alternate Name(s) |
1-Cyano-1-(ethoxycarbonyl)pentyl benzoate
(2-cyano-1-ethoxy-1-oxidanylidene-hexan-2-yl) benzoate
(2-cyano-1-ethoxy-1-oxohexan-2-yl) benzoate
benzoic acid (1-carbethoxy-1-cyano-pentyl) ester
benzoic acid (2-cyano-1-ethoxy-1-oxohexan-2-yl) ester |
| CAS Registry Number |
19788-60-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NO4 |
| InChI |
InChI=1S/C16H19NO4/c1-3-5-11-16(12-17,15(19)20-4-2)21-14(18)13-9-7-6-8-10-13/h6-10H,3-5,11H2,1-2H3 |
| InChIKey |
CWHLGKBVELSITM-UHFFFAOYSA-N |
| Molecular Weight |
289.331 g/mol |
| SMILES |
CCCCC(C#N)(C(=O)OCC)OC(c1ccccc1)=O |
| SPLASH |
splash10-0a4i-9700000000-d106ee793d4fedb1a399 |
| Source of Spectrum |
T-68-3649-0 |
| Wiley ID |
42597 |
