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7-Hydroxy-4-(4'-methylphenylsulphonyl)-4-azatetracyclo[3.3.0.0(2,8).0(3,6)]octane
SpectraBase Compound ID 4F4Ou5frGV1
InChI InChI=1S/C14H15NO3S/c1-6-2-4-7(5-3-6)19(17,18)15-12-8-9-10(8)14(16)11(12)13(9)15/h2-5,8-14,16H,1H3/t8-,9?,10-,11+,12-,13+,14?/m0/s1
InChIKey SLPBFNNYMDVPRN-LWPYIQQUSA-N
Mol Weight 277.34 g/mol
Molecular Formula C14H15NO3S
Exact Mass 277.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RucfQGHdbd
Name 7-Hydroxy-4-(4'-methylphenylsulphonyl)-4-azatetracyclo[3.3.0.0(2,8).0(3,6)]octane
Alternate Name(s) 4-[(4-methylphenyl)sulfonyl]-4-azatetracyclo[3.3.0.0(2,8).0(3,6)]octan-7-ol
CAS Registry Number 136708-83-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO3S
InChI InChI=1S/C14H15NO3S/c1-6-2-4-7(5-3-6)19(17,18)15-12-8-9-10(8)14(16)11(12)13(9)15/h2-5,8-14,16H,1H3/t8-,9?,10-,11+,12-,13+,14?/m0/s1
InChIKey SLPBFNNYMDVPRN-LWPYIQQUSA-N
Molecular Weight 277.338 g/mol
SMILES OC1[C@]2([C@]3(C4[C@@]1([C@]4([C@@]2(N3S(c1ccc(cc1)C)(=O)=O)[H])[H])[H])[H])[H]
SPLASH splash10-00di-0930000000-295a264e8cffbe589896
Source of Spectrum K-124-2891-1
Wiley ID 1280913