| SpectraBase Spectrum ID |
Amf1DvD3cj0 |
| Name |
1-Benzyl-1H-pyrrole-3-carboxylic Acid |
| Alternate Name(s) |
1-(phenylmethyl)-3-pyrrolecarboxylic acid
1-(phenylmethyl)pyrrole-3-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H11NO2 |
| InChI |
InChI=1S/C12H11NO2/c14-12(15)11-6-7-13(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,14,15) |
| InChIKey |
ZDXQRPRUTRYTCC-UHFFFAOYSA-N |
| Molecular Weight |
201.225 g/mol |
| SMILES |
OC(c1c[n](Cc2ccccc2)cc1)=O |
| SPLASH |
splash10-0f6x-9080000000-116551847cb29ae73d68 |
| Source of Spectrum |
F4-42-3349-12 |
| Wiley ID |
1674850 |
