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[1-(4-chlorophenyl)-9H-$b-carbolin-3-yl]methanol
SpectraBase Compound ID Lc69aaWKIDY
InChI InChI=1S/C18H13ClN2O/c19-12-7-5-11(6-8-12)17-18-15(9-13(10-22)20-17)14-3-1-2-4-16(14)21-18/h1-9,21-22H,10H2
InChIKey UDRXVRIDWUFWQX-UHFFFAOYSA-N
Mol Weight 308.77 g/mol
Molecular Formula C18H13ClN2O
Exact Mass 308.071641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DyOrLzH81Zn
Name [1-(4-Chlorophenyl)-9H-$B-carbolin-3-yl]methanol
Comments Computed using HOSE algorithm
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Exact Mass 308.071640746 u
Formula C18H13ClN2O
InChI InChI=1S/C18H13ClN2O/c19-12-7-5-11(6-8-12)17-18-15(9-13(10-22)20-17)14-3-1-2-4-16(14)21-18/h1-9,21-22H,10H2
InChIKey UDRXVRIDWUFWQX-UHFFFAOYSA-N
Molecular Weight 308.768 g/mol
SMILES C1=2NC=3C=CC=CC3C2C=C(N=C1C=1C=CC(=CC1)Cl)CO