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1H-Benzimidazole-2-methanamine, N-(triphenylphosphoranylidene)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-Benzimidazole-2-methanamine, N-(triphenylphosphoranylidene)-
SpectraBase Compound ID 2v05mg85qr9
InChI InChI=1S/C26H22N3P/c1-4-12-21(13-5-1)30(22-14-6-2-7-15-22,23-16-8-3-9-17-23)27-20-26-28-24-18-10-11-19-25(24)29-26/h1-19H,20H2,(H,28,29)
InChIKey KPHBOCPZXMBKAN-UHFFFAOYSA-N
Mol Weight 407.46 g/mol
Molecular Formula C26H22N3P
Exact Mass 407.155135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LKwMGyFmF1f
Name 1H-Benzimidazole-2-methanamine, N-(triphenylphosphoranylidene)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.155134718 u
Formula C26H22N3P
InChI InChI=1S/C26H22N3P/c1-4-12-21(13-5-1)30(22-14-6-2-7-15-22,23-16-8-3-9-17-23)27-20-26-28-24-18-10-11-19-25(24)29-26/h1-19H,20H2,(H,28,29)
InChIKey KPHBOCPZXMBKAN-UHFFFAOYSA-N
Molecular Weight 407.457 g/mol
SMILES C(N=P(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)C1=NC2=CC=CC=C2N1