| SpectraBase Spectrum ID |
3OmsIYSKmpM |
| Name |
1-Acetyl-2-(iodomethyl)-4-phenyl-3-butyn-2-ol |
| Alternate Name(s) |
4-hydroxy-4-(iodomethyl)-6-phenyl-5-hexyn-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13IO2 |
| InChI |
InChI=1S/C13H13IO2/c1-11(15)9-13(16,10-14)8-7-12-5-3-2-4-6-12/h2-6,16H,9-10H2,1H3 |
| InChIKey |
PCBPNDPJHIITTP-UHFFFAOYSA-N |
| Molecular Weight |
328.149 g/mol |
| SMILES |
OC(C#Cc1ccccc1)(CC(=O)C)CI |
| SPLASH |
splash10-00di-0090000000-b93bbacf6109f392283a |
| Source of Spectrum |
J-62-4356-16 |
| Wiley ID |
1325902 |
