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2,7-bis[5'-Chloro-3'-oxapentyloxycarbonyl)methyl]-N-methylphenothiazinhe
SpectraBase Compound ID 1TTSdsFW3nH
InChI InChI=1S/C25H29Cl2NO6S/c1-28-20-4-2-19(17-25(30)34-13-11-32-9-7-27)15-23(20)35-22-5-3-18(14-21(22)28)16-24(29)33-12-10-31-8-6-26/h2-5,14-15H,6-13,16-17H2,1H3
InChIKey MHCDFLBPLZCFRJ-UHFFFAOYSA-N
Mol Weight 542.47 g/mol
Molecular Formula C25H29Cl2NO6S
Exact Mass 541.109264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GRjTxyxuut
Name 2,7-bis[5'-Chloro-3'-oxapentyloxycarbonyl)methyl]-N-methylphenothiazinhe
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Formula C25H29Cl2NO6S
InChI InChI=1S/C25H29Cl2NO6S/c1-28-20-4-2-19(17-25(30)34-13-11-32-9-7-27)15-23(20)35-22-5-3-18(14-21(22)28)16-24(29)33-12-10-31-8-6-26/h2-5,14-15H,6-13,16-17H2,1H3
InChIKey MHCDFLBPLZCFRJ-UHFFFAOYSA-N
Molecular Weight 542.474 g/mol
SMILES c12N(c3c(Sc2ccc(c1)CC(=O)OCCOCCCl)cc(cc3)CC(=O)OCCOCCCl)C
SPLASH splash10-0006-0000090000-b2b276527ff18ac2ec95
Source of Spectrum K1-2001-3273-20
Wiley ID 814196