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(R)-N-Methylcoclaurine
SpectraBase Compound ID 1PXXCn2c19X
InChI InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m1/s1
InChIKey BOKVLBSSPUTWLV-MRXNPFEDSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K34iQ1bERh7
Name (R)-N-Methylcoclaurine
Alternate Name(s) (1R)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol (1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol (R)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol
CAS Registry Number 5096-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m1/s1
InChIKey BOKVLBSSPUTWLV-MRXNPFEDSA-N
Molecular Weight 299.370 g/mol
SMILES Oc1c(cc2c([C@@](Cc3ccc(cc3)O)(N(CC2)C)[H])c1)OC
SPLASH splash10-0006-0900000000-4301e754bed3bd184e78
Source of Spectrum J-40-2469-0
Wiley ID 1302139