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Dimethyl meso-1-tosylpiperidine-3,5-dicarboxylate
SpectraBase Compound ID 4YocrKYsbty
InChI InChI=1S/C16H21NO6S/c1-11-4-6-14(7-5-11)24(20,21)17-9-12(15(18)22-2)8-13(10-17)16(19)23-3/h4-7,12-13H,8-10H2,1-3H3/t12-,13+
InChIKey ABNGCPGIUQFRNE-BETUJISGSA-N
Mol Weight 355.41 g/mol
Molecular Formula C16H21NO6S
Exact Mass 355.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fUiPP3m84X
Name Dimethyl meso-1-tosylpiperidine-3,5-dicarboxylate
Alternate Name(s) dimethyl (3R,5S)-1-[(4-methylphenyl)sulfonyl]-3,5-piperidinedicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C16H21NO6S
InChI InChI=1S/C16H21NO6S/c1-11-4-6-14(7-5-11)24(20,21)17-9-12(15(18)22-2)8-13(10-17)16(19)23-3/h4-7,12-13H,8-10H2,1-3H3/t12-,13+
InChIKey ABNGCPGIUQFRNE-BETUJISGSA-N
Molecular Weight 355.405 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)C[C@](C[C@]1(C(=O)OC)[H])(C(=O)OC)[H]
SPLASH splash10-004i-0090000000-c5a078c1bdff37a4f5f9
Source of Spectrum QC-7-348-3
Wiley ID 869087