| SpectraBase Spectrum ID |
E8RU8EKEfFK |
| Name |
[4-(3-hydroxy-3-methyl-but-1-ynyl)pyrazol-1-yl]-phenyl-methanone |
| Alternate Name(s) |
[4-(3-hydroxy-3-methylbut-1-ynyl)-1-pyrazolyl]-phenylmethanone
[4-(3-methyl-3-oxidanyl-but-1-ynyl)pyrazol-1-yl]-phenyl-methanone |
| CAS Registry Number |
116228-43-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14N2O2 |
| InChI |
InChI=1S/C15H14N2O2/c1-15(2,19)9-8-12-10-16-17(11-12)14(18)13-6-4-3-5-7-13/h3-7,10-11,19H,1-2H3 |
| InChIKey |
YODQBJWVDDYZQI-UHFFFAOYSA-N |
| Molecular Weight |
254.289 g/mol |
| SMILES |
OC(C#Cc1c[n](nc1)C(=O)c1ccccc1)(C)C |
| SPLASH |
splash10-0a4i-0910000000-c958adaaba2f4b81d3a0 |
| Source of Spectrum |
AH-119-259-4 |
| Wiley ID |
1257885 |
