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(2R)-N-{(2S)-2-{[bis(Methylthio) methylidene]amino}pent-4-en-1-oyl}-bornane-10,2-sultam
SpectraBase Compound ID 5SFJCLTzqqd
InChI InChI=1S/C18H28N2O3S3/c1-6-7-13(19-16(24-4)25-5)15(21)20-14-10-12-8-9-18(14,17(12,2)3)11-26(20,22)23/h6,12-14H,1,7-11H2,2-5H3/t12-,13-,14+,18-/m0/s1
InChIKey VCRNMGNOFLSMFL-FLTUCWPJSA-N
Mol Weight 416.61 g/mol
Molecular Formula C18H28N2O3S3
Exact Mass 416.126206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EovvHb10zfU
Name (2R)-N-{(2S)-2-{[bis(Methylthio) methylidene]amino}pent-4-en-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}-3-butenyldithioimidocarbonate
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Formula C18H28N2O3S3
InChI InChI=1S/C18H28N2O3S3/c1-6-7-13(19-16(24-4)25-5)15(21)20-14-10-12-8-9-18(14,17(12,2)3)11-26(20,22)23/h6,12-14H,1,7-11H2,2-5H3/t12-,13-,14+,18-/m0/s1
InChIKey VCRNMGNOFLSMFL-FLTUCWPJSA-N
Molecular Weight 416.613 g/mol
SMILES [C@@]12(N(S(C[C@]11C([C@](C2)(CC1)[H])(C)C)(=O)=O)C([C@@](N=C(SC)SC)(CC=C)[H])=O)[H]
SPLASH splash10-01dr-2903000000-81d6c94ced31e67ee4db
Source of Spectrum H-77-2372-3
Wiley ID 1376205