| SpectraBase Spectrum ID |
B3I0JZzFx56 |
| Name |
1-[(4-Methoxyphenyl)methyl]-4-methyl-2-pyrrolidinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.125928789 u |
| Formula |
C13H17NO2 |
| InChI |
InChI=1S/C13H17NO2/c1-10-7-13(15)14(8-10)9-11-3-5-12(16-2)6-4-11/h3-6,10H,7-9H2,1-2H3 |
| InChIKey |
FRGQEAKCGQQZJB-UHFFFAOYSA-N |
| Molecular Weight |
219.284 g/mol |
| SMILES |
C1(N(CC(C1)C)CC=1C=CC(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916447 |
![1-[(4-Methoxyphenyl)methyl]-4-methyl-2-pyrrolidinone](/api/spectrum/B3I0JZzFx56/structure.png?h=300&w=458 "1-[(4-Methoxyphenyl)methyl]-4-methyl-2-pyrrolidinone")
