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(S)-1-(10,10-Dimethyl-3,3-dioxo-3lambda*6*-thia-4-aza-tricyclo[5.2.1.0*1,5*]dec-4-yl)-2-methyl-oct-6-yn-1-one
SpectraBase Compound ID BEw63Voqwx8
InChI InChI=1S/C19H29NO3S/c1-5-6-7-8-9-14(2)17(21)20-16-12-15-10-11-19(16,18(15,3)4)13-24(20,22)23/h14-16H,7-13H2,1-4H3/t14-,15-,16?,19-/m0/s1
InChIKey DQTOLPRBGSNEPB-CJACNHMQSA-N
Mol Weight 351.51 g/mol
Molecular Formula C19H29NO3S
Exact Mass 351.186815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jLGFccUAo6
Name (S)-1-(10,10-Dimethyl-3,3-dioxo-3lambda*6*-thia-4-aza-tricyclo[5.2.1.0*1,5*]dec-4-yl)-2-methyl-oct-6-yn-1-one
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Formula C19H29NO3S
InChI InChI=1S/C19H29NO3S/c1-5-6-7-8-9-14(2)17(21)20-16-12-15-10-11-19(16,18(15,3)4)13-24(20,22)23/h14-16H,7-13H2,1-4H3/t14-,15-,16?,19-/m0/s1
InChIKey DQTOLPRBGSNEPB-CJACNHMQSA-N
Molecular Weight 351.505 g/mol
SMILES C12N(S(C[C@]11C([C@](C2)(CC1)[H])(C)C)(=O)=O)C(=O)[C@](CCCC#CC)(C)[H]
SPLASH splash10-0aou-9520000000-495b3a87651485fa8897
Source of Spectrum QE-7-5312-100
Synonyms 1-(10,10-Dimethyl-3,3-dioxo-3.lammda.(6)-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl)-2-methyloct-6-yne-1-one 10,10-dimethyl-4-[(2S)-2-methyl-6-octynoyl]-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
Wiley ID 846246