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(2R)-N-{(2S)-2-{[bis(Methylthio)methylidene]amino}-3-methylbutan-1-oyl}-bornane-10,2-sultam
SpectraBase Compound ID AofBSxEQhK3
InChI InChI=1S/C18H30N2O3S3/c1-11(2)14(19-16(24-5)25-6)15(21)20-13-9-12-7-8-18(13,17(12,3)4)10-26(20,22)23/h11-14H,7-10H2,1-6H3/t12-,13+,14-,18-/m0/s1
InChIKey NXBUNIPPYPEOTE-AHXJXLJNSA-N
Mol Weight 418.63 g/mol
Molecular Formula C18H30N2O3S3
Exact Mass 418.141856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmChrohpTFo
Name (2R)-N-{(2S)-2-{[bis(Methylthio)methylidene]amino}-3-methylbutan-1-oyl}-bornane-10,2-sultam
Alternate Name(s) Dimethyl (1S)-1-{[(5R)-10,10-dimethyl-3,3-dioxido-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl]carbonyl}-2-methylpropyldithioimidocarbonate
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Formula C18H30N2O3S3
InChI InChI=1S/C18H30N2O3S3/c1-11(2)14(19-16(24-5)25-6)15(21)20-13-9-12-7-8-18(13,17(12,3)4)10-26(20,22)23/h11-14H,7-10H2,1-6H3/t12-,13+,14-,18-/m0/s1
InChIKey NXBUNIPPYPEOTE-AHXJXLJNSA-N
Molecular Weight 418.629 g/mol
SMILES C(N1S(C[C@@]23C([C@](C[C@@]13[H])(CC2)[H])(C)C)(=O)=O)([C@@](N=C(SC)SC)(C(C)C)[H])=O
SPLASH splash10-0a4r-9500000000-4d9dfe81a967308a7597
Source of Spectrum H-77-2374-3
Wiley ID 1377033