| SpectraBase Compound ID | Cs8IIgCVC5d |
|---|---|
| InChI | InChI=1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3 |
| InChIKey | XRDRKVPNHIWTBX-UHFFFAOYSA-N |
| Mol Weight | 170.59 g/mol |
| Molecular Formula | C8H7ClO2 |
| Exact Mass | 170.013457 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GGFVevnlND2 |
|---|---|
| Name | Methyl 3-chlorobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7ClO2 |
| InChI | InChI=1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3 |
| InChIKey | XRDRKVPNHIWTBX-UHFFFAOYSA-N |
| Molecular Weight | 170.595 g/mol |
| SMILES | c1cc(cc(c1)Cl)C(=O)OC |
| SPLASH | splash10-03ki-9700000000-15138d702c0e4307ed59 |
| Source of Spectrum | QA-52-179-7a |
| Wiley ID | 1796080 |