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

*Links on SpectraBase are not permalinks.
(5aR,11bS)-5a-allyl-9,10-dimethoxy-3-methyl-4,5,5a,6,7,11b-hexahydrophenanthro[3,4-c]isoxazol-1(3H)-one
SpectraBase Compound ID IgTjezqWPs1
InChI InChI=1S/C21H25NO4/c1-5-8-21-9-6-13-11-16(24-3)17(25-4)12-14(13)19(21)18-15(7-10-21)22(2)26-20(18)23/h5,11-12,19H,1,6-10H2,2-4H3/t19-,21+/m0/s1
InChIKey YYHQFERUDSDHMR-PZJWPPBQSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 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 20aPnQ0AMiC
Name (5aR,11bS)-5a-allyl-9,10-dimethoxy-3-methyl-4,5,5a,6,7,11b-hexahydrophenanthro[3,4-c]isoxazol-1(3H)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-5-8-21-9-6-13-11-16(24-3)17(25-4)12-14(13)19(21)18-15(7-10-21)22(2)26-20(18)23/h5,11-12,19H,1,6-10H2,2-4H3/t19-,21+/m0/s1
InChIKey YYHQFERUDSDHMR-PZJWPPBQSA-N
Molecular Weight 355.434 g/mol
SMILES c1(cc2c(CC[C@]3(CC=C)CCC=4N(OC(=O)C4[C@]23[H])C)cc1OC)OC
SPLASH splash10-0o6r-0079000000-07b723ed7e7ee8ad42b0
Source of Spectrum F5-13-2741-14d
Wiley ID 1802109