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3-(1-adamantyl)-6-amino-4-(4-fluorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID Gsob5Y8dVY5
InChI InChI=1S/C23H23FN4O/c24-16-3-1-15(2-4-16)18-17(11-25)21(26)29-22-19(18)20(27-28-22)23-8-12-5-13(9-23)7-14(6-12)10-23/h1-4,12-14,18H,5-10,26H2,(H,27,28)/t12-,13+,14-,18?,23-
InChIKey QQLMQVMIPUAYAI-IBFSXQSYSA-N
Mol Weight 390.46 g/mol
Molecular Formula C23H23FN4O
Exact Mass 390.18559 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J0n9LVJbNAU
Name pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(4-fluorophenyl)-1,4-dihydro-3-tricyclo[3.3.1.1~3,7~]dec-1-yl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.185589539 u
Formula C23H23FN4O
InChI InChI=1S/C23H23FN4O/c24-16-3-1-15(2-4-16)18-17(11-25)21(26)29-22-19(18)20(27-28-22)23-8-12-5-13(9-23)7-14(6-12)10-23/h1-4,12-14,18H,5-10,26H2,(H,27,28)/t12-,13+,14-,18?,23-
InChIKey QQLMQVMIPUAYAI-IBFSXQSYSA-N
Molecular Weight 390.462 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15425
Solvent DMSO-d6
Source Vendor ID: NMR/10320553; Lab Info: VUR; Lab Number: VUR-01012515