SpectraBase Spectrum ID |
JZiSrNKJLSX |
Name |
(6-acetyl-5-methoxy-2,2-dimethyl-chromen-7-yl) 4-methylbenzenesulfonate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H22O6S |
InChI |
InChI=1S/C21H22O6S/c1-13-6-8-15(9-7-13)28(23,24)27-18-12-17-16(10-11-21(3,4)26-17)20(25-5)19(18)14(2)22/h6-12H,1-5H3 |
InChIKey |
MVMMGUSPHASELD-UHFFFAOYSA-N |
Molecular Weight |
402.461 g/mol |
SMILES |
c1(OS(c2ccc(cc2)C)(=O)=O)c(c(OC)c2c(c1)OC(C=C2)(C)C)C(=O)C |
SPLASH |
splash10-000l-5029100000-f5d701dedabc0af4e812 |
Source of Spectrum |
KC-0-2533-20 |
Synonyms |
(6-ethanoyl-5-methoxy-2,2-dimethyl-chromen-7-yl) 4-methylbenzenesulfonate
4-Methylbenzenesulfonic acid (6-acetyl-5-methoxy-2,2-dimethyl-1-benzopyran-7-yl) ester
4-Methylbenzenesulfonic acid (6-acetyl-5-methoxy-2,2-dimethyl-chromen-7-yl) ester |
Wiley ID |
784492 |