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(9,10-dimethoxy-3-phenyl-3,4,6,7-tetrahydro-2H-pyrimido[6,1-a]isoquinolin-1-yl)(phenyl)methanone
SpectraBase Compound ID CqZkBtyifYY
InChI InChI=1S/C27H26N2O3/c1-31-24-15-20-13-14-28-18-29(21-11-7-4-8-12-21)17-23(26(28)22(20)16-25(24)32-2)27(30)19-9-5-3-6-10-19/h3-12,15-16H,13-14,17-18H2,1-2H3
InChIKey WIRUZFJCQBYGOI-UHFFFAOYSA-N
Mol Weight 426.52 g/mol
Molecular Formula C27H26N2O3
Exact Mass 426.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57gZ3BLimBL
Name (9,10-dimethoxy-3-phenyl-3,4,6,7-tetrahydro-2H-pyrimido[6,1-a]isoquinolin-1-yl)(phenyl)methanone
Alternate Name(s) 1-Benzoyl-3-phenyl-8.9-dimethoxy-(tetrahydro)pyrimido[6,1-a]isoquinoline
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26N2O3
InChI InChI=1S/C27H26N2O3/c1-31-24-15-20-13-14-28-18-29(21-11-7-4-8-12-21)17-23(26(28)22(20)16-25(24)32-2)27(30)19-9-5-3-6-10-19/h3-12,15-16H,13-14,17-18H2,1-2H3
InChIKey WIRUZFJCQBYGOI-UHFFFAOYSA-N
Molecular Weight 426.516 g/mol
SMILES C1(=C2N(CCc3c2cc(c(OC)c3)OC)CN(C1)c1ccccc1)C(=O)c1ccccc1
SPLASH splash10-03fr-0009500000-76385ae14e640397843e
Source of Spectrum D1-328-2373-11
Wiley ID 1548425