| SpectraBase Spectrum ID |
4UzeNhi0h7W |
| Name |
6-Ethyl-6-methyl-4-(2-(phenylsulfonyl)ethyl)tetrahydro-2H-pyran-2-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.123880358 u |
| Formula |
C16H22O4S |
| InChI |
InChI=1S/C16H22O4S/c1-3-16(2)12-13(11-15(17)20-16)9-10-21(18,19)14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3 |
| InChIKey |
XCYWSMOLDFRLPD-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201701865 |
| Molecular Weight |
310.408 g/mol |
| Quality |
244 |
| Reported Formula |
C16H22O4S |
| SMILES |
C(C1(CC(CC(O1)=O)CCS(C=1C=CC=CC1)(=O)=O)C)C |
| SPLASH |
splash10-001i-9260000000-7c8f18e44f608559434a |
| Sample Comments |
dr = 1.2:1 |
| Source of Spectrum |
QE-23-SM15-3i (DOI: 10.1002/chem.201701865) |
| Wiley ID |
1905571 |
