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N-[2-[2-Methyl-1-(p-tolylsulfonyl)propyl]heptanoyl]piperidine
SpectraBase Compound ID 4PiYw3zVQG9
InChI InChI=1S/C23H37NO3S/c1-5-6-8-11-21(23(25)24-16-9-7-10-17-24)22(18(2)3)28(26,27)20-14-12-19(4)13-15-20/h12-15,18,21-22H,5-11,16-17H2,1-4H3
InChIKey IKKWMRKJRFSLHI-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C23H37NO3S
Exact Mass 407.249415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ks1UgWSPQW
Name N-[2-[2-Methyl-1-(p-tolylsulfonyl)propyl]heptanoyl]piperidine
Comments Less than 3 mono-isotopic peaks
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Formula C23H37NO3S
InChI InChI=1S/C23H37NO3S/c1-5-6-8-11-21(23(25)24-16-9-7-10-17-24)22(18(2)3)28(26,27)20-14-12-19(4)13-15-20/h12-15,18,21-22H,5-11,16-17H2,1-4H3
InChIKey IKKWMRKJRFSLHI-UHFFFAOYSA-N
Molecular Weight 407.613 g/mol
SMILES C1N(CCCC1)C(C(CCCCC)C(C(C)C)S(=O)(=O)c1ccc(cc1)C)=O
SPLASH splash10-0udi-0090000000-1829c2c63d81396a7a19
Source of Spectrum AJ-66-2343-3
Synonyms 1-(2-{2-methyl-1-[(4-methylphenyl)sulfonyl]propyl}heptanoyl)piperidine 1-isopropyl-2-(1-piperidinylcarbonyl)heptyl 4-methylphenyl sulfone
Wiley ID 772174