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5-Propylindolizidin-7-yl 1'-imidazolecarbothioate
SpectraBase Compound ID 6vbVkSxagPH
InChI InChI=1S/C15H23N3OS/c1-2-4-12-9-14(10-13-5-3-7-18(12)13)19-15(20)17-8-6-16-11-17/h6,8,11-14H,2-5,7,9-10H2,1H3/t12-,13+,14+/m1/s1
InChIKey DXUYPMJSZWIMNV-RDBSUJKOSA-N
Mol Weight 293.43 g/mol
Molecular Formula C15H23N3OS
Exact Mass 293.156184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kh0396v1ktB
Name 5-Propylindolizidin-7-yl 1'-imidazolecarbothioate
Alternate Name(s) (5R,7S,8aS)-5-Propylindolizidin-7-yl 1'-imidazolecarbothioate 1-imidazolecarbothioic acid O-[(5R,7S,8aS)-5-propyl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl] ester O-[(5R,7S,8aS)-5-propyl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl] imidazole-1-carbothioate
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Formula C15H23N3OS
InChI InChI=1S/C15H23N3OS/c1-2-4-12-9-14(10-13-5-3-7-18(12)13)19-15(20)17-8-6-16-11-17/h6,8,11-14H,2-5,7,9-10H2,1H3/t12-,13+,14+/m1/s1
InChIKey DXUYPMJSZWIMNV-RDBSUJKOSA-N
Molecular Weight 293.429 g/mol
SMILES C([n]1cncc1)(O[C@@]1(C[C@]2(N(CCC2)[C@@](C1)(CCC)[H])[H])[H])=S
SPLASH splash10-00di-1910000000-27ce56a84474ca8f580a
Source of Spectrum U1-1998-869-16
Wiley ID 751221