| SpectraBase Spectrum ID |
JbzV4YNq9Ze |
| Name |
Methyl (4aS*)-4a-methyl-2,5-dioxo-3,4,4a,6,7,8-hexahydronaphthalenecarboxylate |
| Alternate Name(s) |
methyl (4aS)-4a-methyl-2,5-dioxo-2,3,4,4a,5,6,7,8-octahydro-1-naphthalenecarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O4 |
| InChI |
InChI=1S/C13H16O4/c1-13-7-6-9(14)11(12(16)17-2)8(13)4-3-5-10(13)15/h3-7H2,1-2H3/t13-/m0/s1 |
| InChIKey |
NCIRYIJZVVTTDL-ZDUSSCGKSA-N |
| Molecular Weight |
236.267 g/mol |
| SMILES |
C1(=C2[C@](C(=O)CCC2)(C)CCC1=O)C(=O)OC |
| SPLASH |
splash10-03di-0910000000-d3d1ffdc4240c6bf030b |
| Source of Spectrum |
F-56-7178-6 |
| Wiley ID |
858335 |
