| SpectraBase Spectrum ID |
nltJBTOsb3 |
| Name |
Mesuximide-m (ho-) isomer-1 ac P663 |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.100107963 u |
| Formula |
C14H15NO4 |
| InChI |
InChI=1S/C14H15NO4/c1-9(16)19-11-6-4-10(5-7-11)14(2)8-12(17)15(3)13(14)18/h4-7H,8H2,1-3H3 |
| InChIKey |
UFBITGJZEWXIBN-UHFFFAOYSA-N |
| Molecular Weight |
261.277 g/mol |
| SMILES |
C=1(C2(C)CC(=O)N(C2=O)C)C=CC(=CC1)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871495 |
