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10-Methyl-N,N'-bis(4'-phenylbutyl)-phenothiazine-3,7-dimethanamine
SpectraBase Compound ID IYTjbJ7VmbI
InChI InChI=1S/C35H41N3S/c1-38-32-20-18-30(26-36-22-10-8-16-28-12-4-2-5-13-28)24-34(32)39-35-25-31(19-21-33(35)38)27-37-23-11-9-17-29-14-6-3-7-15-29/h2-7,12-15,18-21,24-25,36-37H,8-11,16-17,22-23,26-27H2,1H3
InChIKey CNPUXUFJVUMWGM-UHFFFAOYSA-N
Mol Weight 535.8 g/mol
Molecular Formula C35H41N3S
Exact Mass 535.30212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ciq75i0Zohy
Name 10-Methyl-N,N'-bis(4'-phenylbutyl)-phenothiazine-3,7-dimethanamine
Alternate Name(s) N-[(10-methyl-7-{[(4-phenylbutyl)amino]methyl}-10H-phenothiazin-3-yl)methyl]-4-phenyl-1-butanamine N-[(10-methyl-7-{[(4-phenylbutyl)amino]methyl}-10H-phenothiazin-3-yl)methyl]-N-(4-phenylbutyl)amine
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Formula C35H41N3S
InChI InChI=1S/C35H41N3S/c1-38-32-20-18-30(26-36-22-10-8-16-28-12-4-2-5-13-28)24-34(32)39-35-25-31(19-21-33(35)38)27-37-23-11-9-17-29-14-6-3-7-15-29/h2-7,12-15,18-21,24-25,36-37H,8-11,16-17,22-23,26-27H2,1H3
InChIKey CNPUXUFJVUMWGM-UHFFFAOYSA-N
Molecular Weight 535.794 g/mol
SMILES N(Cc1ccc2c(Sc3c(ccc(CNCCCCc4ccccc4)c3)N2C)c1)CCCCc1ccccc1
SPLASH splash10-000i-9300000000-61a953e00cd493d3ebbf
Source of Spectrum D8-325-239-10
Wiley ID 1514361