SpectraBase Spectrum ID |
DpBmF4XbjEO |
Name |
para-Cyanobenzoic Acid Isobutyl Ester |
Alternate Name(s) |
Isobutyl para-cyanobenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO2 |
InChI |
InChI=1S/C12H13NO2/c1-9(2)8-15-12(14)11-5-3-10(7-13)4-6-11/h3-6,9H,8H2,1-2H3 |
InChIKey |
RYFXHNFLVQQUPO-UHFFFAOYSA-N |
Ionization Type |
EI-B |
Molecular Weight |
203.241 g/mol |
SMILES |
C(#N)c1ccc(cc1)C(=O)OCC(C)C |
SPLASH |
splash10-053r-8900000000-d71280c8ff88dd9363fd |
Source of Spectrum |
SRH-2022-999-0 |
Wiley ID |
1823470 |