| SpectraBase Compound ID | DxWrATjZBfN |
|---|---|
| InChI | InChI=1S/C6H6ClNO2/c1-10-6(9)4-2-3-5(7)8-4/h2-3,8H,1H3 |
| InChIKey | YXDKRRSLSSBHFH-UHFFFAOYSA-N |
| Mol Weight | 159.57 g/mol |
| Molecular Formula | C6H6ClNO2 |
| Exact Mass | 159.008706 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6Oapn8afEEG |
|---|---|
| Name | 5-CHLORO-1H-PYRROLE-2-CARBOXYLIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C6H6NO2Cl |
| InChI | InChI=1S/C6H6ClNO2/c1-10-6(9)4-2-3-5(7)8-4/h2-3,8H,1H3 |
| InChIKey | YXDKRRSLSSBHFH-UHFFFAOYSA-N |
| Molecular Weight | 159.0086 |
| SMILES | [nH]1c(ccc1Cl)C(OC)=O |
| SPLASH | splash10-004i-2900000000-3f0f1344bcd7cbd27a9b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |