| SpectraBase Spectrum ID |
8Sn2hhCy9hF |
| Name |
4-Chlorobenzoic acid methyl ester |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
170.013457163 u |
| Formula |
C8H7ClO2 |
| InChI |
InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey |
LXNFVVDCCWUUKC-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5977B |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202103669 |
| Molecular Weight |
170.595 g/mol |
| Quality |
389 |
| SMILES |
C1(Cl)=CC=C(C=C1)C(OC)=O |
| SPLASH |
splash10-000i-1900000000-4f401a59a2d44646c7b7 |
| Source of Spectrum |
QE-28-SM44-5ai (DOI: 10.1002/chem.202103669) |
| Wiley ID |
1898379 |
