B9M
Summary
| Name: | (10E)-hexadec-10-en-12-yn-1-ol |
| Formula: | C16 H28 O |
| Formal charge: | 0 |
| Formula weight: | 236.393 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (10E)-hexadec-10-en-12-yn-1-ol |
| OpenEye OEToolkits | 1.6.1 | (E)-hexadec-10-en-12-yn-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | C(#C\C=C\CCCCCCCCCO)CCC |
| SMILES_CANONICAL | CACTVS | 3.352 | CCCC#C\C=C\CCCCCCCCCO |
| SMILES | CACTVS | 3.352 | CCCC#CC=CCCCCCCCCCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CCCC#C\C=C\CCCCCCCCCO |
| SMILES | OpenEye OEToolkits | 1.6.1 | CCCC#CC=CCCCCCCCCCO |
| InChI | InChI | 1.03 | InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h6-7,17H,2-3,8-16H2,1H3/b7-6+ |
| InChIKey | InChI | 1.03 | CVGZIQCJXLSQQU-VOTSOKGWSA-N |
