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Methyl cis-2-(Benzyloxymethyl)-1-tosyl-3-methyl-tetrahydropyridin-6-ylethanoate
SpectraBase Compound ID 1StR2poVZIh
InChI InChI=1S/C24H29NO5S/c1-18-9-13-22(14-10-18)31(27,28)25-21(15-24(26)29-3)12-11-19(2)23(25)17-30-16-20-7-5-4-6-8-20/h4-11,13-14,21,23H,12,15-17H2,1-3H3
InChIKey KKEKPEBTQPVYCH-UHFFFAOYSA-N
Mol Weight 443.56 g/mol
Molecular Formula C24H29NO5S
Exact Mass 443.176644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGrRpwtRWwZ
Name Methyl cis-2-(Benzyloxymethyl)-1-tosyl-3-methyl-tetrahydropyridin-6-ylethanoate
Alternate Name(s) Methyl {(5S,6R)-6-[(benzyloxy)methyl]-5-methyl-1-[(4-methylphenyl)sulfonyl]-1,4,5,6-tetrahydro-2-pyridinyl}acetate
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Formula C24H29NO5S
InChI InChI=1S/C24H29NO5S/c1-18-9-13-22(14-10-18)31(27,28)25-21(15-24(26)29-3)12-11-19(2)23(25)17-30-16-20-7-5-4-6-8-20/h4-11,13-14,21,23H,12,15-17H2,1-3H3
InChIKey KKEKPEBTQPVYCH-UHFFFAOYSA-N
Molecular Weight 443.558 g/mol
SMILES C1(N(S(c2ccc(cc2)C)(=O)=O)C(C(=CC1)C)COCc1ccccc1)CC(=O)OC
SPLASH splash10-0006-9101000000-7759546da8953ec4c015
Source of Spectrum J-61-4598-17
Wiley ID 1385730