| SpectraBase Spectrum ID |
IW2Tf8FVqyK |
| Name |
2-Methyl-3-[(phenylmethyl)amino]-2H-furan-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
203.094628661 u |
| Formula |
C12H13NO2 |
| InChI |
InChI=1S/C12H13NO2/c1-9-11(7-12(14)15-9)13-8-10-5-3-2-4-6-10/h2-7,9,13H,8H2,1H3 |
| InChIKey |
HTSMMFDXJTYLIZ-UHFFFAOYSA-N |
| Molecular Weight |
203.241 g/mol |
| SMILES |
C1(OC(C(=C1)NCC=1C=CC=CC1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912314 |
![2-methyl-3-[(phenylmethyl)amino]-2H-furan-5-one](/api/spectrum/IW2Tf8FVqyK/structure.png?h=300&w=458 "2-methyl-3-[(phenylmethyl)amino]-2H-furan-5-one")
