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7-Cyclohexyl-2-ethyl-5-methyl-2-(4-methylphenyl)-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide
SpectraBase Compound ID F5DpGIv9mPD
InChI InChI=1S/C22H33NO2S/c1-4-22(18-12-10-17(2)11-13-18)15-14-21(3)16-20(22)23(26(21,24)25)19-8-6-5-7-9-19/h10-13,19-20H,4-9,14-16H2,1-3H3/t20-,21-,22-/m1/s1
InChIKey QBPBAQJCUOIMAX-YPAWHYETSA-N
Mol Weight 375.6 g/mol
Molecular Formula C22H33NO2S
Exact Mass 375.2232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fOj16lKEv9
Name 7-Cyclohexyl-2-ethyl-5-methyl-2-(4-methylphenyl)-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C22H33NO2S
InChI InChI=1S/C22H33NO2S/c1-4-22(18-12-10-17(2)11-13-18)15-14-21(3)16-20(22)23(26(21,24)25)19-8-6-5-7-9-19/h10-13,19-20H,4-9,14-16H2,1-3H3/t20-,21-,22-/m1/s1
InChIKey QBPBAQJCUOIMAX-YPAWHYETSA-N
Molecular Weight 375.571 g/mol
SMILES [C@]12(N(S([C@](CC[C@@]2(c2ccc(cc2)C)CC)(C1)C)(=O)=O)C1CCCCC1)[H]
SPLASH splash10-004i-0902000000-86e4e79228cf486a38a0
Source of Spectrum F-54-8971-16
Synonyms (1R*,2R*,5R*)-7-Cyclohexyl-2-ethyl-5-methyl-2-(4-methylphenyl)-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide 7-cyclohexyl-2-ethyl-5-methyl-2-(4-methylphenyl)-6-thia-7-azabicyclo[3.2.1]octane 6,6-dioxide
Wiley ID 808167