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tert-Butyl 4-(Benzylamino)-3-tosyl-butanoate
SpectraBase Compound ID 2zWd30HQrxE
InChI InChI=1S/C22H29NO4S/c1-17-10-12-19(13-11-17)28(25,26)20(14-21(24)27-22(2,3)4)16-23-15-18-8-6-5-7-9-18/h5-13,20,23H,14-16H2,1-4H3
InChIKey OXERRTAEPPBEGA-UHFFFAOYSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qo7YnvRmpl
Name tert-Butyl 4-(Benzylamino)-3-tosyl-butanoate
Alternate Name(s) tert-Butyl 4-(benzylamino)-3-[(4-methylphenyl)sulfonyl]butanoate
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Formula C22H29NO4S
InChI InChI=1S/C22H29NO4S/c1-17-10-12-19(13-11-17)28(25,26)20(14-21(24)27-22(2,3)4)16-23-15-18-8-6-5-7-9-18/h5-13,20,23H,14-16H2,1-4H3
InChIKey OXERRTAEPPBEGA-UHFFFAOYSA-N
Molecular Weight 403.537 g/mol
SMILES N(CC(S(c1ccc(cc1)C)(=O)=O)CC(OC(C)(C)C)=O)Cc1ccccc1
SPLASH splash10-052f-9500000000-3f5f8994ea80de019f8c
Source of Spectrum F-53-4802-12
Wiley ID 801347