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3-(3-N-Tosylaminopropyl)-1-(p-xylenylmethyl)benzene
SpectraBase Compound ID 8PohpXxEOky
InChI InChI=1S/C25H29NO2S/c1-19-10-13-25(14-11-19)29(27,28)26-15-5-8-22-6-4-7-23(17-22)18-24-16-20(2)9-12-21(24)3/h4,6-7,9-14,16-17,26H,5,8,15,18H2,1-3H3
InChIKey BGAYGSYFUMVTFU-UHFFFAOYSA-N
Mol Weight 407.57 g/mol
Molecular Formula C25H29NO2S
Exact Mass 407.1919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LttT0ShZ1T
Name 3-(3-N-Tosylaminopropyl)-1-(p-xylenylmethyl)benzene
Alternate Name(s) N-{3-[3-(2,5-dimethylbenzyl)phenyl]propyl}-4-methylbenzenesulfonamide
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Formula C25H29NO2S
InChI InChI=1S/C25H29NO2S/c1-19-10-13-25(14-11-19)29(27,28)26-15-5-8-22-6-4-7-23(17-22)18-24-16-20(2)9-12-21(24)3/h4,6-7,9-14,16-17,26H,5,8,15,18H2,1-3H3
InChIKey BGAYGSYFUMVTFU-UHFFFAOYSA-N
Molecular Weight 407.572 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)CCCc1cc(Cc2c(ccc(c2)C)C)ccc1
SPLASH splash10-0pvl-6940100000-e41a0cc98cbde67108bb
Source of Spectrum QB-20-842-2
Wiley ID 860449