| SpectraBase Spectrum ID |
HvgvDQgzK3b |
| Name |
1-Phenylhepta-1,3,5-triyne |
| Alternate Name(s) |
Hepta-1,3,5-triyne<1-phenyl-> |
| CAS Registry Number |
4300-27-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H8 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C13H8/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,1H3 |
| InChIKey |
ACKWHAMNCLDPRO-UHFFFAOYSA-N |
| Molecular Weight |
164.207 g/mol |
| SMILES |
c1(ccccc1)C#CC#CC#CC |
| SPLASH |
splash10-03dr-3900000000-d0499bd13ad7e672fbeb |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886406 |
