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1H-isoindole-2-hexanamide, N-(cyanomethyl)-2,3-dihydro-1,3-dioxo-
SpectraBase Compound ID 5CKojXoEoQd
InChI InChI=1S/C16H17N3O3/c17-9-10-18-14(20)8-2-1-5-11-19-15(21)12-6-3-4-7-13(12)16(19)22/h3-4,6-7H,1-2,5,8,10-11H2,(H,18,20)
InChIKey AEJHCCWAXVOWDJ-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C16H17N3O3
Exact Mass 299.126991 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGhDF9SCCwg
Name 1H-isoindole-2-hexanamide, N-(cyanomethyl)-2,3-dihydro-1,3-dioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.126991416 u
Formula C16H17N3O3
InChI InChI=1S/C16H17N3O3/c17-9-10-18-14(20)8-2-1-5-11-19-15(21)12-6-3-4-7-13(12)16(19)22/h3-4,6-7H,1-2,5,8,10-11H2,(H,18,20)
InChIKey AEJHCCWAXVOWDJ-UHFFFAOYSA-N
Molecular Weight 299.330 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15039
Solvent DMSO-d6
Source Vendor ID: NMR/11210945; Lab Info: L-02; Lab Number: L-02/0102013