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N-(3-chlorobenzo[b]thien-2-yl)-1-(diphenylphosphinyl)formamide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

N-(3-chlorobenzo[b]thien-2-yl)-1-(diphenylphosphinyl)formamide
SpectraBase Compound ID F23pmc7Rva4
InChI InChI=1S/C21H15ClNO2PS/c22-19-17-13-7-8-14-18(17)27-20(19)23-21(24)26(25,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H,(H,23,24)
InChIKey FNTNJLCIPOFLOU-UHFFFAOYSA-N
Mol Weight 411.84 g/mol
Molecular Formula C21H15ClNO2PS
Exact Mass 411.024965 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8BOu1n7w0F9
Name N-(3-Chlorobenzo[B]thien-2-yl)-1-(diphenylphosphinyl)formamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.024964597 u
Formula C21H15ClNO2PS
InChI InChI=1S/C21H15ClNO2PS/c22-19-17-13-7-8-14-18(17)27-20(19)23-21(24)26(25,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H,(H,23,24)
InChIKey FNTNJLCIPOFLOU-UHFFFAOYSA-N
Molecular Weight 411.843 g/mol
SMILES N(C(P(C=1C=CC=CC1)(C=1C=CC=CC1)=O)=O)C=1SC=2C=CC=CC2C1Cl