John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7ybeRh5rjaJ SpectraBase Spectrum ID=2KLhiKuQrmy

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(2R)-2-amino-3-[4-(3-methylphenyl)anilino]-1-propanethiol
SpectraBase Compound ID 7ybeRh5rjaJ
InChI InChI=1S/C16H20N2S/c1-12-3-2-4-14(9-12)13-5-7-16(8-6-13)18-10-15(17)11-19/h2-9,15,18-19H,10-11,17H2,1H3/t15-/m1/s1
InChIKey NLKGJZMAJPDFMS-OAHLLOKOSA-N
Mol Weight 272.41 g/mol
Molecular Formula C16H20N2S
Exact Mass 272.134721 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID 2KLhiKuQrmy
Name (2R)-2-amino-3-[4-(3-methylphenyl)anilino]-1-propanethiol
Alternate Name(s) (2R)-2-amino-3-[4-(3-methylphenyl)anilino]propane-1-thiol (2R)-2-amino-3-[4-(m-tolyl)anilino]propane-1-thiol (2R)-2-azanyl-3-[[4-(3-methylphenyl)phenyl]amino]propane-1-thiol
Classification Biphenyls and derivatives
Comments Less than 3 mono-isotopic peaks
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Formula C16H20N2S
InChI InChI=1S/C16H20N2S/c1-12-3-2-4-14(9-12)13-5-7-16(8-6-13)18-10-15(17)11-19/h2-9,15,18-19H,10-11,17H2,1H3/t15-/m1/s1
InChIKey NLKGJZMAJPDFMS-OAHLLOKOSA-N
SPLASH splash10-0002-0910000000-2e96e7709cb30319c149
Source of Spectrum E1-39-223-8
SpectraBase Batch ID Leq9buJhCuG
Wiley ID 1598699