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N-Benzyl-3-isobutyl-3-tosylpiperidine
SpectraBase Compound ID D8CaBIWwZCn
InChI InChI=1S/C23H31NO2S/c1-19(2)16-23(27(25,26)22-12-10-20(3)11-13-22)14-7-15-24(18-23)17-21-8-5-4-6-9-21/h4-6,8-13,19H,7,14-18H2,1-3H3
InChIKey YNFMNZJTPONWLO-UHFFFAOYSA-N
Mol Weight 385.57 g/mol
Molecular Formula C23H31NO2S
Exact Mass 385.20755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3M4NwxigcNx
Name N-Benzyl-3-isobutyl-3-tosylpiperidine
Alternate Name(s) 1-Benzyl-3-isobutyl-3-piperidinyl 4-methylphenyl sulfone 1-Benzyl-3-isobutyl-3-[(4-methylphenyl)sulfonyl]piperidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31NO2S
InChI InChI=1S/C23H31NO2S/c1-19(2)16-23(27(25,26)22-12-10-20(3)11-13-22)14-7-15-24(18-23)17-21-8-5-4-6-9-21/h4-6,8-13,19H,7,14-18H2,1-3H3
InChIKey YNFMNZJTPONWLO-UHFFFAOYSA-N
Molecular Weight 385.566 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)(CN(Cc2ccccc2)CCC1)CC(C)C
SPLASH splash10-000f-9510000000-d08b1b7322f02fa0028e
Source of Spectrum F-53-4810-27
Wiley ID 801604