| SpectraBase Spectrum ID |
5A1O6JlFbTC |
| Name |
1H-Indole, 3-(1,3,3a,4,7,7a-hexahydro-6-methyl-1,3-dioxo-4-isobenzofuranyl)-1-methoxy-, (3a.alpha.,4.beta.,7a.alpha.)-(.+-.)- |
| Alternate Name(s) |
(1RS,2SR,3SR)-3-(1'-methoxyindol-3'-yl)-5-methylcyclohex-4-ene-1,2-dicarboxylic anhydride
(3aS,4S,7aR)-4-(1-methoxy-1H-indol-3-yl)-6-methyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione |
| CAS Registry Number |
131938-91-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17NO4 |
| InChI |
InChI=1S/C18H17NO4/c1-10-7-12(16-13(8-10)17(20)23-18(16)21)14-9-19(22-2)15-6-4-3-5-11(14)15/h3-7,9,12-13,16H,8H2,1-2H3/t12-,13-,16+/m1/s1 |
| InChIKey |
NVMQCLVXAAXYHI-IOASZLSFSA-N |
| Molecular Weight |
311.337 g/mol |
| SMILES |
c1([C@@]2([C@@]3(C(OC([C@]3([H])CC(=C2)C)=O)=O)[H])[H])c[n](OC)c2c1cccc2 |
| SPLASH |
splash10-02ai-0912000000-646672ed9ba6845487b0 |
| Source of Spectrum |
KC-1990-2492-21 |
| Wiley ID |
1312496 |
