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2-[3,5-bis(chloranyl)-2,6-bis(propylsulfanyl)phenyl]-3-nitro-aniline
SpectraBase Compound ID L9ezAtvYPAS
InChI InChI=1S/C18H20Cl2N2O2S2/c1-3-8-25-17-11(19)10-12(20)18(26-9-4-2)16(17)15-13(21)6-5-7-14(15)22(23)24/h5-7,10H,3-4,8-9,21H2,1-2H3
InChIKey RMTWCTZQZUHFNZ-UHFFFAOYSA-N
Mol Weight 431.4 g/mol
Molecular Formula C18H20Cl2N2O2S2
Exact Mass 430.034326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPANGSkIlUl
Name 2-[3,5-bis(chloranyl)-2,6-bis(propylsulfanyl)phenyl]-3-nitro-aniline
Comments Less than 3 mono-isotopic peaks
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Formula C18H20Cl2N2O2S2
InChI InChI=1S/C18H20Cl2N2O2S2/c1-3-8-25-17-11(19)10-12(20)18(26-9-4-2)16(17)15-13(21)6-5-7-14(15)22(23)24/h5-7,10H,3-4,8-9,21H2,1-2H3
InChIKey RMTWCTZQZUHFNZ-UHFFFAOYSA-N
Molecular Weight 431.396 g/mol
SMILES Nc1c(-c2c(c(Cl)cc(c2SCCC)Cl)SCCC)c(N(=O)=O)ccc1
SPLASH splash10-014i-0090000000-8f847ead9657c242e12c
Source of Spectrum F-68-9586-48
Synonyms 2-[3,5-dichloro-2,6-bis(propylsulfanyl)phenyl]-3-nitro-aniline 2-[3,5-dichloro-2,6-bis(propylthio)phenyl]-3-nitroaniline [2-[3,5-dichloro-2,6-bis(propylthio)phenyl]-3-nitro-phenyl]amine
Wiley ID 1573837