| SpectraBase Spectrum ID |
C35Wf2CQxnW |
| Name |
5-Heptynoic acid, 7-phenyl- |
| Alternate Name(s) |
7-Phenyl-5-heptynoic acid
7-phenylhept-5-ynoic acid |
| CAS Registry Number |
88255-07-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c14-13(15)11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10H,2,7-8,11H2,(H,14,15) |
| InChIKey |
ZZIFARXSZVIBOL-UHFFFAOYSA-N |
| Molecular Weight |
202.253 g/mol |
| SMILES |
OC(CCCC#CCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-1789aca47f5b163c62f1 |
| Source of Spectrum |
J-51-3215-0 |
| Wiley ID |
1200048 |
