SpectraBase Spectrum ID |
7TVkEjqyFtm |
Name |
(3S,4R)-4(4-Methoxybenzoyl)-3-methyltetrahydropyran-2-one |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H16O4 |
InChI |
InChI=1S/C14H16O4/c1-9-12(7-8-18-14(9)16)13(15)10-3-5-11(17-2)6-4-10/h3-6,9,12H,7-8H2,1-2H3/t9-,12+/m0/s1 |
InChIKey |
HDRGGSBQFXQTDM-JOYOIKCWSA-N |
Molecular Weight |
248.278 g/mol |
SMILES |
C([C@]1([C@@](C(=O)OCC1)(C)[H])[H])(c1ccc(cc1)OC)=O |
SPLASH |
splash10-000i-0900000000-0d4e04d350b549eab4d1 |
Source of Spectrum |
F-52-10092-10 |
Synonyms |
(3S,4R)-4-(4-methoxybenzoyl)-3-methyltetrahydro-2H-pyran-2-one |
Wiley ID |
797813 |