| SpectraBase Spectrum ID |
DCryfLkiz35 |
| Name |
3-Hydroxy-3-methyl-2-oxobutyl benzoate |
| Appearance |
Colorless crystals |
| Carrier Gas |
helium |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.089208927 u |
| Formula |
C12H14O4 |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C12H14O4/c1-12(2,15)10(13)8-16-11(14)9-6-4-3-5-7-9/h3-7,15H,8H2,1-2H3 |
| InChIKey |
RCDSENUJAFNKSW-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901226 |
| Molecular Weight |
222.240 g/mol |
| Quality |
151 |
| SMILES |
OC(C)(C)C(COC(=O)C1=CC=CC=C1)=O |
| SPLASH |
splash10-0a4i-8900000000-25da34977f163c1830db |
| Source of Spectrum |
K1-2019-SM4-3a (DOI: 10.1002/ejoc.201901226) |
| Wiley ID |
1892269 |
