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(7R,14R)-14-Methyl-12-(toluene-4-sulfonyl)-1,4-dithia-12-aza-dispiro[4.1.4.3]tetradecan-8-one
SpectraBase Compound ID ClrbTRzg2dX
InChI InChI=1S/C19H25NO3S3/c1-14-5-7-16(8-6-14)26(22,23)20-12-15(2)19(24-10-11-25-19)13-18(20)9-3-4-17(18)21/h5-8,15H,3-4,9-13H2,1-2H3/t15-,18-/m1/s1
InChIKey OSMPRIRFXPNBFK-CRAIPNDOSA-N
Mol Weight 411.59 g/mol
Molecular Formula C19H25NO3S3
Exact Mass 411.099657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NhjPLfNH1B
Name (7R,14R)-14-Methyl-12-(toluene-4-sulfonyl)-1,4-dithia-12-aza-dispiro[4.1.4.3]tetradecan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3S3
InChI InChI=1S/C19H25NO3S3/c1-14-5-7-16(8-6-14)26(22,23)20-12-15(2)19(24-10-11-25-19)13-18(20)9-3-4-17(18)21/h5-8,15H,3-4,9-13H2,1-2H3/t15-,18-/m1/s1
InChIKey OSMPRIRFXPNBFK-CRAIPNDOSA-N
Literature Reference DOI 10.1002/adsc.201400932
Molecular Weight 411.593 g/mol
SMILES [C@]12(N(C[C@@](C)(C3(C2)SCCS3)[H])S(c2ccc(cc2)C)(=O)=O)C(CCC1)=O
SPLASH splash10-000x-8359100000-f9bb49e05d8c50915076
Source of Spectrum ASC-357-747/SM17-2j_2
Wiley ID 1770967