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2-(Heptadec-8-enyl)-5-chloro-1hbenzimidazole
SpectraBase Compound ID BHLcC1rgfAG
InChI InChI=1S/C24H37ClN2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-26-22-19-18-21(25)20-23(22)27-24/h9-10,18-20H,2-8,11-17H2,1H3,(H,26,27)/b10-9+
InChIKey FKHHPANXRAKVCO-MDZDMXLPSA-N
Mol Weight 389.0 g/mol
Molecular Formula C24H37ClN2
Exact Mass 388.264527 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70IfTFJBNx5
Name 2-(Heptadec-8-enyl)-5-chloro-1hbenzimidazole
Comments Computed using HOSE algorithm
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Exact Mass 388.264526899 u
Formula C24H37ClN2
InChI InChI=1S/C24H37ClN2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-26-22-19-18-21(25)20-23(22)27-24/h9-10,18-20H,2-8,11-17H2,1H3,(H,26,27)/b10-9+
InChIKey FKHHPANXRAKVCO-MDZDMXLPSA-N
Molecular Weight 389.027 g/mol
SMILES C1(=NC=2C(N1)=CC=C(C2)Cl)CCCCCCC\C=C\CCCCCCCC