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Meso-(4-chlorophenyl)dipyrromethane
SpectraBase Compound ID 8oqEED7wRl7
InChI InChI=1S/C15H13ClN2/c16-12-7-5-11(6-8-12)15(13-3-1-9-17-13)14-4-2-10-18-14/h1-10,15,17-18H
InChIKey XSGSKSXDYFBJMM-UHFFFAOYSA-N
Mol Weight 256.74 g/mol
Molecular Formula C15H13ClN2
Exact Mass 256.076726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4CRfs8OyDsa
Name Meso-(4-chlorophenyl)dipyrromethane
Comments Computed using HOSE algorithm
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Exact Mass 256.076726127 u
Formula C15H13ClN2
InChI InChI=1S/C15H13ClN2/c16-12-7-5-11(6-8-12)15(13-3-1-9-17-13)14-4-2-10-18-14/h1-10,15,17-18H
InChIKey XSGSKSXDYFBJMM-UHFFFAOYSA-N
Molecular Weight 256.736 g/mol
SMILES C(C=1NC=CC1)(C=1NC=CC1)C1=CC=C(Cl)C=C1