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(3,3,4a-trimethyl-1-methylsulfanyl-4,5-dihydropyrimido[1,6-a]benzimidazol-8-yl)-phenyl-methanone
SpectraBase Compound ID 1Mm1rniuivZ
InChI InChI=1S/C21H23N3OS/c1-20(2)13-21(3)22-16-11-10-15(18(25)14-8-6-5-7-9-14)12-17(16)24(21)19(23-20)26-4/h5-12,22H,13H2,1-4H3
InChIKey FEXBBABZBSKBGW-UHFFFAOYSA-N
Mol Weight 365.5 g/mol
Molecular Formula C21H23N3OS
Exact Mass 365.156184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4EJEfF1svL
Name (3,3,4a-trimethyl-1-methylsulfanyl-4,5-dihydropyrimido[1,6-a]benzimidazol-8-yl)-phenyl-methanone
Alternate Name(s) [3,3,4a-trimethyl-1-(methylthio)-4,5-dihydropyrimido[1,6-a]benzimidazol-8-yl]-phenyl-methanone [3,3,4a-trimethyl-1-(methylthio)-4,5-dihydropyrimido[1,6-a]benzimidazol-8-yl]-phenylmethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3OS
InChI InChI=1S/C21H23N3OS/c1-20(2)13-21(3)22-16-11-10-15(18(25)14-8-6-5-7-9-14)12-17(16)24(21)19(23-20)26-4/h5-12,22H,13H2,1-4H3
InChIKey FEXBBABZBSKBGW-UHFFFAOYSA-N
Molecular Weight 365.495 g/mol
SMILES N1c2c(N3C1(CC(N=C3SC)(C)C)C)cc(cc2)C(=O)c1ccccc1
SPLASH splash10-0ug0-0097000000-7a799e5b70a8b6946e2b
Source of Spectrum SO-0-881-10
Wiley ID 876638