SpectraBase Spectrum ID |
EPSq0bdBJ51 |
Name |
(1S,8R,8aR) 8-methyl-4-oxo-3,4,8,8a-tetrahydro-1H-isochromen-1-yl acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H14O4 |
InChI |
InChI=1S/C12H14O4/c1-7-4-3-5-9-10(14)6-15-12(11(7)9)16-8(2)13/h3-5,7,11-12H,6H2,1-2H3/t7-,11-,12+/m1/s1 |
InChIKey |
UUABNTLBUPRTKU-HFKOZYHYSA-N |
Literature Reference DOI |
10.1021/ol301602h |
Molecular Weight |
222.240 g/mol |
SMILES |
C1=C[C@]([C@]2([C@@](OCC(C2=C1)=O)(OC(=O)C)[H])[H])(C)[H] |
SPLASH |
splash10-06r5-3900000000-9b112c67a41c6822be85 |
Source of Spectrum |
A1-14-3740/SMS3-4a |
Synonyms |
(1S,8R,8aR)-8-methyl-4-oxo-3,4,8,8a-tetrahydro-1H-isochromen-1-yl acetate |
Wiley ID |
1750429 |