| SpectraBase Compound ID | Ae73RoAsRYd |
|---|---|
| InChI | InChI=1S/C8H10N2O2/c1-12-8(11)10-7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11) |
| InChIKey | UFDGMXHPQNDESO-UHFFFAOYSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C8H10N2O2 |
| Exact Mass | 166.074228 g/mol |
| SpectraBase Spectrum ID | 3fJv26QAQdS |
|---|---|
| Name | Carbamic acid, (4-aminophenyl)-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.074227568 u |
| Formula | C8H10N2O2 |
| InChI | InChI=1S/C8H10N2O2/c1-12-8(11)10-7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11) |
| InChIKey | UFDGMXHPQNDESO-UHFFFAOYSA-N |
| Molecular Weight | 166.180 g/mol |
| SMILES | C(NC1=CC=C(C=C1)N)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938245 |