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4H-1-benzopyran-3-carbonitrile, 2,7-diamino-4-(4-fluorophenyl)-
SpectraBase Compound ID 2MJF9ts5ZMC
InChI InChI=1S/C16H12FN3O/c17-10-3-1-9(2-4-10)15-12-6-5-11(19)7-14(12)21-16(20)13(15)8-18/h1-7,15H,19-20H2
InChIKey RCCOFOKSOMYESV-UHFFFAOYSA-N
Mol Weight 281.29 g/mol
Molecular Formula C16H12FN3O
Exact Mass 281.09644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EGLo8HEkls0
Name 4H-1-benzopyran-3-carbonitrile, 2,7-diamino-4-(4-fluorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.096440180 u
Formula C16H12FN3O
InChI InChI=1S/C16H12FN3O/c17-10-3-1-9(2-4-10)15-12-6-5-11(19)7-14(12)21-16(20)13(15)8-18/h1-7,15H,19-20H2
InChIKey RCCOFOKSOMYESV-UHFFFAOYSA-N
Molecular Weight 281.290 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_282
Solvent DMSO-d6
Source Vendor ID: NMR/8315103; Lab Info: NVN; Lab Number: NVN-0000619
Temperature 29.85 °C