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5-[N-[2-(tert-Butoxycarbonylazo)-1-(methoxycarbonyl)propyl]]-5-[N-[1-(tert-butoxycarbonyl)azo]ethyl]-2-(methylimino)-3-methylthiazolidin-4-one
SpectraBase Compound ID 968thMEAeGS
InChI InChI=1S/C22H36N6O7S/c1-12(24-26-18(31)34-20(3,4)5)14(15(29)33-11)22(16(30)28(10)17(23-9)36-22)13(2)25-27-19(32)35-21(6,7)8/h14H,1-11H3,(H,26,31)(H,27,32)/b23-17+,24-12+,25-13+
InChIKey HFJNZNDSEXIDIM-PVQSERPDSA-N
Mol Weight 528.6 g/mol
Molecular Formula C22H36N6O7S
Exact Mass 528.236619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FA7xwzPh2wf
Name 5-[N-[2-(tert-Butoxycarbonylazo)-1-(methoxycarbonyl)propyl]]-5-[N-[1-(tert-butoxycarbonyl)azo]ethyl]-2-(methylimino)-3-methylthiazolidin-4-one
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Formula C22H36N6O7S
InChI InChI=1S/C22H36N6O7S/c1-12(24-26-18(31)34-20(3,4)5)14(15(29)33-11)22(16(30)28(10)17(23-9)36-22)13(2)25-27-19(32)35-21(6,7)8/h14H,1-11H3,(H,26,31)(H,27,32)/b23-17+,24-12+,25-13+
InChIKey HFJNZNDSEXIDIM-PVQSERPDSA-N
Molecular Weight 528.625 g/mol
SMILES N(C(OC(C)(C)C)=O)\N=C\(C(C1(\C(=N\NC(OC(C)(C)C)=O)C)C(N(C)\C(S1)=N/C)=O)C(=O)OC)C
SPLASH splash10-000t-0069100000-411764342587d57ef07c
Source of Spectrum F-55-13434-10
Synonyms 5-[N-[2-(tert-Butoxycarbonylazi)-1-(methoxycarbonyl)propyl]]-5-[N-[1-(tert-butoxycarbonyl)azi]ethyl]-2-(methylimino)-3-methylthiazolidin-4-one tert-Butyl (2E)-2-(2-{(2E)-5-[(1E)-N-(tert-butoxycarbonyl)ethanehydrazonoyl]-3-methyl-2-[(E)-methylimino]-4-oxo-1,3-thiazolidin-5-yl}-3-methoxy-1-methyl-3-oxopropylidene)hydrazinecarboxylate
Wiley ID 839822