| SpectraBase Spectrum ID |
IbmohSTLhhL |
| Name |
Methyl 4-cyanobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H7NO2 |
| InChI |
InChI=1S/C9H7NO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,1H3 |
| InChIKey |
KKZMIDYKRKGJHG-UHFFFAOYSA-N |
| Instrument Name |
Agilent 6890-5973N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/asia.202100776 |
| Molecular Weight |
161.160 g/mol |
| SMILES |
COC(c1ccc(cc1)C#N)=O |
| SPLASH |
splash10-001i-1900000000-b617c79f6166a34bf2d4 |
| Source of Spectrum |
CAJ-16-SM33-33-1 |
| Wiley ID |
1866995 |
