| SpectraBase Spectrum ID |
7zwnJv9fw4q |
| Name |
4-(Cyanomethyl)benzoic acid 2,2,4,4-tetramethyl-3-oxopentyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H23NO3 |
| InChI |
InChI=1S/C18H23NO3/c1-17(2,3)16(21)18(4,5)12-22-15(20)14-8-6-13(7-9-14)10-11-19/h6-9H,10,12H2,1-5H3 |
| InChIKey |
FENOZPNIQFBHLN-UHFFFAOYSA-N |
| Molecular Weight |
301.386 g/mol |
| SMILES |
C(c1ccc(cc1)CC#N)(=O)OCC(C(C(C)(C)C)=O)(C)C |
| SPLASH |
splash10-052f-8940000000-71be95537ff08f7bae8d |
| Source of Spectrum |
KC-61-9581-10 |
| Synonyms |
2,2,4,4-tetramethyl-3-oxopentyl 4-(cyanomethyl)benzoate |
| Wiley ID |
1630760 |
