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Butyl 2-Benzyl-6-methyl-5,7,8-trimethoxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
SpectraBase Compound ID 69b0mLQT03s
InChI InChI=1S/C25H33NO5/c1-6-7-15-31-25(27)21-20-19(13-14-26(21)16-18-11-9-8-10-12-18)22(28-3)17(2)23(29-4)24(20)30-5/h8-12,21H,6-7,13-16H2,1-5H3
InChIKey URSAHRLPSKHBCX-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C25H33NO5
Exact Mass 427.235873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hovtY58Vrg
Name Butyl 2-Benzyl-6-methyl-5,7,8-trimethoxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Alternate Name(s) butyl 2-benzyl-5,7,8-trimethoxy-6-methyl-1,2,3,4-tetrahydro-1-isoquinolinecarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C25H33NO5
InChI InChI=1S/C25H33NO5/c1-6-7-15-31-25(27)21-20-19(13-14-26(21)16-18-11-9-8-10-12-18)22(28-3)17(2)23(29-4)24(20)30-5/h8-12,21H,6-7,13-16H2,1-5H3
InChIKey URSAHRLPSKHBCX-UHFFFAOYSA-N
Molecular Weight 427.541 g/mol
SMILES C1(N(CCc2c(c(c(c(c12)OC)OC)C)OC)Cc1ccccc1)C(=O)OCCCC
SPLASH splash10-0006-9003000000-068b8c69da32641a8e22
Source of Spectrum E1-37-1496-3
Wiley ID 1517746