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1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-2-hydroxy-3-methyl-1-(3,4,5-trimethoxyphenyl)-, cis-
SpectraBase Compound ID KxgS2kl3BRM
InChI InChI=1S/C21H24N2O4/c1-12-9-15-14-7-5-6-8-16(14)22-19(15)20(23(12)24)13-10-17(25-2)21(27-4)18(11-13)26-3/h5-8,10-12,20,22,24H,9H2,1-4H3/t12-,20+/m1/s1
InChIKey DEEJOYLEYQKFNH-ODXCJYRJSA-N
Mol Weight 368.43 g/mol
Molecular Formula C21H24N2O4
Exact Mass 368.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zRlQSNaBWV
Name 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-2-hydroxy-3-methyl-1-(3,4,5-trimethoxyphenyl)-, cis-
Alternate Name(s) (1S,3R)-3-methyl-1-(3,4,5-trimethoxyphenyl)-1,3,4,9-tetrahydro-2H-.beta.-carbolin-2-ol cis-1-(3',4',5'-trimethoxy-phenyl)-2-hydroxy-3-methyl-1,2,3,4-tetrahydro-.beta.-carboline
CAS Registry Number 129169-04-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O4
InChI InChI=1S/C21H24N2O4/c1-12-9-15-14-7-5-6-8-16(14)22-19(15)20(23(12)24)13-10-17(25-2)21(27-4)18(11-13)26-3/h5-8,10-12,20,22,24H,9H2,1-4H3/t12-,20+/m1/s1
InChIKey DEEJOYLEYQKFNH-ODXCJYRJSA-N
Molecular Weight 368.433 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N([C@@](C2)(C)[H])O)(c1cc(OC)c(c(c1)OC)OC)[H]
SPLASH splash10-0pdr-0039000000-2784a35c89ef14ee0571
Source of Spectrum F-46-844-6
Wiley ID 1353137