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1-[(E)-(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino]thiourea
SpectraBase Compound ID 4d3VWythpEO
InChI InChI=1S/C13H17N5O2S/c14-13(21)16-15-9-10-4-5-11(12(8-10)18(19)20)17-6-2-1-3-7-17/h4-5,8-9H,1-3,6-7H2,(H3,14,16,21)/b15-9+
InChIKey VLBPUEZVYOLBRT-OQLLNIDSSA-N
Mol Weight 307.37 g/mol
Molecular Formula C13H17N5O2S
Exact Mass 307.110296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID In1tZMWFd9y
Name 1-[(E)-(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino]thiourea
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Formula C13H17N5O2S
InChI InChI=1S/C13H17N5O2S/c14-13(21)16-15-9-10-4-5-11(12(8-10)18(19)20)17-6-2-1-3-7-17/h4-5,8-9H,1-3,6-7H2,(H3,14,16,21)/b15-9+
InChIKey VLBPUEZVYOLBRT-OQLLNIDSSA-N
Molecular Weight 307.372 g/mol
SMILES N(C(=S)N)\N=C\c1cc(N(=O)=O)c(N2CCCCC2)cc1
SPLASH splash10-08fr-8952000000-85ec3396ff6ffb03f3ac
Synonyms [(E)-(3-nitro-4-piperidin-1-ylphenyl)methylideneamino]thiourea [(E)-(3-nitro-4-piperidino-benzylidene)amino]thiourea [(E)-[3-nitro-4-(1-piperidinyl)phenyl]methylideneamino]thiourea [(E)-[3-nitro-4-(1-piperidyl)phenyl]methyleneamino]thiourea
Wiley ID 1450954