| SpectraBase Spectrum ID |
4Ho76YbjD3o |
| Name |
(3aR*,4R*,6aR*)-Acetic acid (44-methyl-5-oxo-3a,5,6,6a-tetrahydro-4H-pentalen-1-ylidene)methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c1-7-10-4-3-9(6-15-8(2)13)11(10)5-12(7)14/h3-4,6-7,10-11H,5H2,1-2H3/b9-6+/t7-,10+,11+/m1/s1 |
| InChIKey |
JILAMCRYOBRSAW-OJCSILTNSA-N |
| Molecular Weight |
206.241 g/mol |
| SMILES |
[C@]12([C@](\C(=C\OC(=O)C)C=C2)(CC([C@@]1(C)[H])=O)[H])[H] |
| SPLASH |
splash10-0006-9000000000-d153d5dc98c991ca9e9b |
| Source of Spectrum |
J-64-661-11 |
| Synonyms |
(3aR*,4R*,6aR*)-Acetic acid (4-methyl-5-oxo-3a,5,6,6a-tetrahydro-4H-pentalen-1-ylidenr)methyl ester
acetic acid [(E)-[(3aR,4R,6aR)-4-methyl-5-oxo-3a,4,6,6a-tetrahydropentalen-1-ylidene]methyl] ester
[(E)-[(3aR,4R,6aR)-4-methyl-5-oxo-3a,4,6,6a-tetrahydropentalen-1-ylidene]methyl] acetate
[(E)-[(3aR,4R,6aR)-4-methyl-5-oxidanylidene-3a,4,6,6a-tetrahydropentalen-1-ylidene]methyl] ethanoate |
| Wiley ID |
1529195 |
