SpectraBase Spectrum ID |
GLcXpxLQ26t |
Name |
Tetrahydro-3-(N-benzylacetamido)-2,5-furandione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
247.084457899 u |
Formula |
C13H13NO4 |
InChI |
InChI=1S/C13H13NO4/c1-9(15)14(8-10-5-3-2-4-6-10)11-7-12(16)18-13(11)17/h2-6,11H,7-8H2,1H3 |
InChIKey |
DVZJEISHKUVODN-UHFFFAOYSA-N |
Molecular Weight |
247.250 g/mol |
SMILES |
C1(C(N(C(=O)C)CC=2C=CC=CC2)CC(O1)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983187 |