FP6
Summary
Name: | pyrrolidine-1-carbaldehyde |
Formula: | C5 H9 N O |
Formal charge: | 0 |
Formula weight: | 99.131 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | pyrrolidine-1-carbaldehyde |
OpenEye OEToolkits | 1.7.0 | pyrrolidine-1-carbaldehyde |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=CN1CCCC1 |
SMILES_CANONICAL | CACTVS | 3.370 | O=CN1CCCC1 |
SMILES | CACTVS | 3.370 | O=CN1CCCC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C1CCN(C1)C=O |
SMILES | OpenEye OEToolkits | 1.7.0 | C1CCN(C1)C=O |
InChI | InChI | 1.03 | InChI=1S/C5H9NO/c7-5-6-3-1-2-4-6/h5H,1-4H2 |
InChIKey | InChI | 1.03 | AGRIQBHIKABLPJ-UHFFFAOYSA-N |