SpectraBase Compound ID | DpLORJ5FkX |
---|---|
InChI | InChI=1S/C4H8N2O/c5-3(7)4(6)1-2-4/h1-2,6H2,(H2,5,7) |
InChIKey | JFGXRDGYMLGBBB-UHFFFAOYSA-N |
Mol Weight | 100.12 g/mol |
Molecular Formula | C4H8N2O |
Exact Mass | 100.063663 g/mol |
SpectraBase Spectrum ID | Io6hDSkMLbw |
---|---|
Name | 1-Aminocyclopropanecarboxamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 100.063662885 u |
Formula | C4H8N2O |
InChI | InChI=1S/C4H8N2O/c5-3(7)4(6)1-2-4/h1-2,6H2,(H2,5,7) |
InChIKey | JFGXRDGYMLGBBB-UHFFFAOYSA-N |
Molecular Weight | 100.121 g/mol |
SMILES | C1(C(=O)N)(CC1)N |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.825663 |