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2,6-Methano-3-benzazocin-11-ol, 1,2,3,4,5,6-hexahydro-8-methoxy-3,11-dimethyl-6-(2-propenyl)-, (2.alpha.,6.alpha.,11R*)-, ethanedioate (1:1) (salt)
SpectraBase Compound ID 7il1ukYwmcr
InChI InChI=1S/C18H25NO2.C2H2O4/c1-5-8-18-9-10-19(3)16(17(18,2)20)11-13-6-7-14(21-4)12-15(13)18;3-1(4)2(5)6/h5-7,12,16,20H,1,8-11H2,2-4H3;(H,3,4)(H,5,6)/t16-,17-,18+;/m0./s1
InChIKey LJHZLOOFTWGXTI-WSLRHHBVSA-N
Mol Weight 377.44 g/mol
Molecular Formula C20H27NO6
Exact Mass 377.183838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XUFTosTKmg
Name 2,6-Methano-3-benzazocin-11-ol, 1,2,3,4,5,6-hexahydro-8-methoxy-3,11-dimethyl-6-(2-propenyl)-, (2.alpha.,6.alpha.,11R*)-, ethanedioate (1:1) (salt)
CAS Registry Number 53649-39-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO6
InChI InChI=1S/C18H25NO2.C2H2O4/c1-5-8-18-9-10-19(3)16(17(18,2)20)11-13-6-7-14(21-4)12-15(13)18;3-1(4)2(5)6/h5-7,12,16,20H,1,8-11H2,2-4H3;(H,3,4)(H,5,6)/t16-,17-,18+;/m0./s1
InChIKey LJHZLOOFTWGXTI-WSLRHHBVSA-N
Molecular Weight 377.437 g/mol
SMILES OC(C(=O)O)=O.O[C@@]1([C@]2(c3c(C[C@@]1(N(C)CC2)[H])ccc(c3)OC)CC=C)C
SPLASH splash10-0abc-9000000000-a79d86b1961054cd123a
Source of Spectrum W5-32483-0-0
Synonyms (1S,9S,13R)-1-allyl-4-methoxy-10,13-dimethyl-10-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6-trien-13-ol oxalate 2,6-Methano-3-benzazocin-11-ol, 1,2,3,4,5,6-hexahydro-8-methoxy-3,11-dimethyl-6-(2-propenyl)-, (2.alpha.,6.alpha.,11R*)-, ethanedioate (1:1) (sa 2,6-Methano-3-benzazocin-11-ol, 1,2,3,4,5,6-hexahydro-8-methoxy-3,11-dimethyl-6-(2-propenyl)-, (2.alpha.,6.alpha.,11r@)-, ethanedioate (1:1) (salt)
Wiley ID 1358242