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2-(8-(diphenylmethylene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzonitrile
SpectraBase Compound ID FsdXT73XDMM
InChI InChI=1S/C29H20N2O2/c30-17-20-13-7-8-14-23(20)31-28(32)26-21-15-16-22(27(26)29(31)33)25(21)24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,21-22,26-27H/t21-,22+,26?,27?
InChIKey OFRQBAXULZRXOQ-PRSBGKBPSA-N
Mol Weight 428.49 g/mol
Molecular Formula C29H20N2O2
Exact Mass 428.152478 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F7y4gez64SL
Name 2-(8-(diphenylmethylene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.152477890 u
Formula C29H20N2O2
InChI InChI=1S/C29H20N2O2/c30-17-20-13-7-8-14-23(20)31-28(32)26-21-15-16-22(27(26)29(31)33)25(21)24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,21-22,26-27H/t21-,22+,26?,27?
InChIKey OFRQBAXULZRXOQ-PRSBGKBPSA-N
Molecular Weight 428.491 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1236
Solvent DMSO-d6
Source Vendor ID: ZI/8107571; Lab Info: LD; Lab Number: LD-31b0201