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erythro-1-(Benzylamino)-4,4-dimethyl-2-tosyl-3-pentanol
SpectraBase Compound ID 3nznSfOtyw6
InChI InChI=1S/C21H29NO3S/c1-16-10-12-18(13-11-16)26(24,25)19(20(23)21(2,3)4)15-22-14-17-8-6-5-7-9-17/h5-13,19-20,22-23H,14-15H2,1-4H3
InChIKey VAZRUVUXKSQQAF-UHFFFAOYSA-N
Mol Weight 375.53 g/mol
Molecular Formula C21H29NO3S
Exact Mass 375.186815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8vJFVf1BTh
Name erythro-1-(Benzylamino)-4,4-dimethyl-2-tosyl-3-pentanol
Alternate Name(s) threo-1-(Benzylamino)-4,4-dimethyl-2-tosyl-3-pentanol 1-(benzylamino)-4,4-dimethyl-2-[(4-methylphenyl)sulfonyl]-3-pentanol
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Formula C21H29NO3S
InChI InChI=1S/C21H29NO3S/c1-16-10-12-18(13-11-16)26(24,25)19(20(23)21(2,3)4)15-22-14-17-8-6-5-7-9-17/h5-13,19-20,22-23H,14-15H2,1-4H3
InChIKey VAZRUVUXKSQQAF-UHFFFAOYSA-N
Molecular Weight 375.527 g/mol
SMILES OC(C(CNCc1ccccc1)S(c1ccc(cc1)C)(=O)=O)C(C)(C)C
SPLASH splash10-052f-9600000000-0f46691f78b60f0bdf49
Source of Spectrum F-53-4804-12
Wiley ID 801340