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N-Benzyl-3-tosyl-3-piperidylphenylmethanone
SpectraBase Compound ID 1kR54sa5Pkl
InChI InChI=1S/C26H27NO3S/c1-21-13-15-24(16-14-21)31(29,30)26(25(28)23-11-6-3-7-12-23)17-8-18-27(20-26)19-22-9-4-2-5-10-22/h2-7,9-16H,8,17-20H2,1H3/t26-/m0/s1
InChIKey QBTLFENRNCABPF-UHFFFAOYSA-N
Mol Weight 433.57 g/mol
Molecular Formula C26H27NO3S
Exact Mass 433.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zx9CEsBdGk
Name N-Benzyl-3-tosyl-3-piperidylphenylmethanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO3S
InChI InChI=1S/C26H27NO3S/c1-21-13-15-24(16-14-21)31(29,30)26(25(28)23-11-6-3-7-12-23)17-8-18-27(20-26)19-22-9-4-2-5-10-22/h2-7,9-16H,8,17-20H2,1H3/t26-/m0/s1
InChIKey QBTLFENRNCABPF-UHFFFAOYSA-N
Molecular Weight 433.566 g/mol
SMILES [C@@]1(S(c2ccc(cc2)C)(=O)=O)(C(=O)c2ccccc2)CN(Cc2ccccc2)CCC1
SPLASH splash10-002f-9230000000-6e1bd10065e6e4e0a10a
Source of Spectrum F-53-4810-27
Synonyms {1-benzyl-3-[(4-methylphenyl)sulfonyl]-3-piperidinyl}(phenyl)methanone
Wiley ID 801600