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(4bS,8aS)-1-isopropyl-2-methoxy-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-3-amine
SpectraBase Compound ID KS9ZH2qI21R
InChI InChI=1S/C21H33NO/c1-13(2)18-14-8-9-17-20(3,4)10-7-11-21(17,5)15(14)12-16(22)19(18)23-6/h12-13,17H,7-11,22H2,1-6H3/t17-,21+/m0/s1
InChIKey SIGLDXACBDHKFL-LAUBAEHRSA-N
Mol Weight 315.5 g/mol
Molecular Formula C21H33NO
Exact Mass 315.256215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cgk2ucS5xc5
Name (4bS,8aS)-1-isopropyl-2-methoxy-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-3-amine
Alternate Name(s) (4bS,8aS)-2-methoxy-4b,8,8-trimethyl-1-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-3-amine [(4bS,8aS)-1-isopropyl-2-methoxy-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-3-yl]amine
CAS Registry Number 84104-93-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33NO
InChI InChI=1S/C21H33NO/c1-13(2)18-14-8-9-17-20(3,4)10-7-11-21(17,5)15(14)12-16(22)19(18)23-6/h12-13,17H,7-11,22H2,1-6H3/t17-,21+/m0/s1
InChIKey SIGLDXACBDHKFL-LAUBAEHRSA-N
Molecular Weight 315.501 g/mol
SMILES Nc1c(OC)c(c2c([C@@]3([C@@](CC2)(C(C)(C)CCC3)[H])C)c1)C(C)C
SPLASH splash10-0uxr-0398000000-03d0987ae9e8522d7afb
Source of Spectrum B-35-1691-0
Wiley ID 1316218