SpectraBase Spectrum ID |
4X6l2J7IYbE |
Name |
(+-)-2-carbomethoxyspiro[3.3]heptane-6-carboxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
197.105193344 u |
Formula |
C10H15NO3 |
InChI |
InChI=1S/C10H15NO3/c1-14-9(13)7-4-10(5-7)2-6(3-10)8(11)12/h6-7H,2-5H2,1H3,(H2,11,12) |
InChIKey |
LTNFEMSXOCQLKD-UHFFFAOYSA-N |
Molecular Weight |
197.234 g/mol |
SMILES |
C12(CC(C2)C(=O)OC)CC(C(=O)N)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.814635 |