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3,5-Difluoro-4-heptyloxy-2-propylthioaniline
SpectraBase Compound ID 6OKAYx7UjpR
InChI InChI=1S/C16H25F2NOS/c1-3-5-6-7-8-9-20-15-12(17)11-13(19)16(14(15)18)21-10-4-2/h11H,3-10,19H2,1-2H3
InChIKey YNWMRWQVCMZVEX-UHFFFAOYSA-N
Mol Weight 317.44 g/mol
Molecular Formula C16H25F2NOS
Exact Mass 317.162492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L76XFiFmHLs
Name 3,5-Difluoro-4-heptyloxy-2-propylthioaniline
Alternate Name(s) 3,5-difluoro-4-(heptyloxy)-2-(propylsulfanyl)aniline 3,5-difluoro-4-(heptyloxy)-2-(propylsulfanyl)phenylamine
Comments Less than 3 mono-isotopic peaks
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Formula C16H25F2NOS
InChI InChI=1S/C16H25F2NOS/c1-3-5-6-7-8-9-20-15-12(17)11-13(19)16(14(15)18)21-10-4-2/h11H,3-10,19H2,1-2H3
InChIKey YNWMRWQVCMZVEX-UHFFFAOYSA-N
Molecular Weight 317.439 g/mol
SMILES Nc1c(c(c(c(c1)F)OCCCCCCC)F)SCCC
SPLASH splash10-004i-0902000000-514b064b50aa6c705f26
Source of Spectrum KC-61-2330-1
Wiley ID 1628122