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2-isonicotinoyl-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene
SpectraBase Compound ID 9IGdDmdZ6nQ
InChI InChI=1S/C14H10F6N2O/c15-13(16,17)12(14(18,19)20)9-1-2-10(7-9)22(12)11(23)8-3-5-21-6-4-8/h1-6,9-10H,7H2/t9-,10+/m1/s1
InChIKey MQCFZJWVHSGGLN-ZJUUUORDSA-N
Mol Weight 336.24 g/mol
Molecular Formula C14H10F6N2O
Exact Mass 336.069732 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzCZXTWx37u
Name 2-isonicotinoyl-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H10F6N2O/c15-13(16,17)12(14(18,19)20)9-1-2-10(7-9)22(12)11(23)8-3-5-21-6-4-8/h1-6,9-10H,7H2/t9-,10+/m1/s1
InChIKey MQCFZJWVHSGGLN-ZJUUUORDSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5673
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D23519; Labnumber: SOK-1476; SBI_ID: SBI-005675
Temperature 318 °C