For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(3aR,8aR,9aR)-3-[[2-(5-methoxy-1H-indol-3-yl)ethylamino]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one

View entire compound with spectra: 1 MS (GC)

(3aR,8aR,9aR)-3-[[2-(5-methoxy-1H-indol-3-yl)ethylamino]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
SpectraBase Compound ID 95kZa7q2S8H
InChI InChI=1S/C26H34N2O3/c1-16-5-4-9-26(2)13-24-20(12-22(16)26)21(25(29)31-24)15-27-10-8-17-14-28-23-7-6-18(30-3)11-19(17)23/h6-7,11,14,20-21,24,27-28H,4-5,8-10,12-13,15H2,1-3H3/t20-,21?,24-,26-/m1/s1
InChIKey FGIKHFZJZSAPJO-XAQHNUDOSA-N
Mol Weight 422.6 g/mol
Molecular Formula C26H34N2O3
Exact Mass 422.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2RW1K5DLdPh
Name (3aR,8aR,9aR)-3-[[2-(5-methoxy-1H-indol-3-yl)ethylamino]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34N2O3
InChI InChI=1S/C26H34N2O3/c1-16-5-4-9-26(2)13-24-20(12-22(16)26)21(25(29)31-24)15-27-10-8-17-14-28-23-7-6-18(30-3)11-19(17)23/h6-7,11,14,20-21,24,27-28H,4-5,8-10,12-13,15H2,1-3H3/t20-,21?,24-,26-/m1/s1
InChIKey FGIKHFZJZSAPJO-XAQHNUDOSA-N
Molecular Weight 422.569 g/mol
SMILES N(CC1C(O[C@@]2(C[C@]3(CCCC(=C3C[C@]12[H])C)C)[H])=O)CCc1c[nH]c2c1cc(cc2)OC
SPLASH splash10-03di-3920000000-3dacba62fc5cdab334a2
Synonyms (3aR,8aR,9aR)-3-[[2-(5-methoxy-1H-indol-3-yl)ethylamino]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Wiley ID 1442677