PEA
Summary
| Name: | 2-PHENYLETHYLAMINE |
| Formula: | C8 H12 N |
| Formal charge: | 1 |
| Formula weight: | 122.188 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-phenylethanaminium |
| OpenEye OEToolkits | 1.5.0 | phenethylazanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | c1ccccc1CC[NH3+] |
| SMILES_CANONICAL | CACTVS | 3.341 | [NH3+]CCc1ccccc1 |
| SMILES | CACTVS | 3.341 | [NH3+]CCc1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CC[NH3+] |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CC[NH3+] |
| InChI | InChI | 1.03 | InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2/p+1 |
| InChIKey | InChI | 1.03 | BHHGXPLMPWCGHP-UHFFFAOYSA-O |
