| SpectraBase Compound ID | JgCwAWWJ8Af |
|---|---|
| InChI | InChI=1S/C20H27N/c1-15(2)18-10-11-20(4)16(3)13-21(19(20)12-18)14-17-8-6-5-7-9-17/h5-11,16,18-19H,1,12-14H2,2-4H3/t16-,18+,19-,20-/m1/s1 |
| InChIKey | ITUOMDJRVFOZLQ-GSEOLPGOSA-N |
| Mol Weight | 281.44 g/mol |
| Molecular Formula | C20H27N |
| Exact Mass | 281.21435 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LSWIuActzBC |
|---|---|
| Name | (1S,3aR,6R,7aR)-1-Benzyl-6-isopropenyl-3,3a-dimethyl-2,3,3a,6,7,7a-hexahydroindole |
| Alternate Name(s) | (3aR,6R,7aR)-1-benzyl-6-isopropenyl-3,3a-dimethyl-2,3,3a,6,7,7a-hexahydro-1H-indole (3S,3aR,6R,7aR)-1-Benzyl-6-isopropenyl-3,3a-dimethyl-2,3,3a,6,7,7a-hexahydroindole (3S,3aR,6R,7aR)-3,3a-dimethyl-6-(1-methylethenyl)-1-(phenylmethyl)-3,6,7,7a-tetrahydro-2H-indole (3S,3aR,6R,7aR)-1-benzyl-3,3a-dimethyl-6-prop-1-en-2-yl-3,6,7,7a-tetrahydro-2H-indole (3S,3aR,6R,7aR)-3,3a-dimethyl-1-(phenylmethyl)-6-prop-1-en-2-yl-3,6,7,7a-tetrahydro-2H-indole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27N |
| InChI | InChI=1S/C20H27N/c1-15(2)18-10-11-20(4)16(3)13-21(19(20)12-18)14-17-8-6-5-7-9-17/h5-11,16,18-19H,1,12-14H2,2-4H3/t16-,18+,19-,20-/m1/s1 |
| InChIKey | ITUOMDJRVFOZLQ-GSEOLPGOSA-N |
| Molecular Weight | 281.443 g/mol |
| SMILES | [C@]12(N(C[C@]([C@]2(C=C[C@@](C1)(C(=C)C)[H])C)(C)[H])Cc1ccccc1)[H] |
| SPLASH | splash10-0006-9460000000-1bc8896552e1a9c68bad |
| Source of Spectrum | J-59-5639-23 |
| Wiley ID | 1285181 |