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1H-isoindole-2-butanamide, 2,3-dihydro-1,3-dioxo-N-(4H-1,2,4-triazol-3-yl)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-isoindole-2-butanamide, 2,3-dihydro-1,3-dioxo-N-(4H-1,2,4-triazol-3-yl)-
SpectraBase Compound ID 1QAqAKt1jmG
InChI InChI=1S/C14H13N5O3/c20-11(17-14-15-8-16-18-14)6-3-7-19-12(21)9-4-1-2-5-10(9)13(19)22/h1-2,4-5,8H,3,6-7H2,(H2,15,16,17,18,20)
InChIKey KLTXHYVLQNCIBM-UHFFFAOYSA-N
Mol Weight 299.29 g/mol
Molecular Formula C14H13N5O3
Exact Mass 299.101839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6wpB6WtPdOV
Name 1H-isoindole-2-butanamide, 2,3-dihydro-1,3-dioxo-N-(4H-1,2,4-triazol-3-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 299.101839296 u
Formula C14H13N5O3
InChI InChI=1S/C14H13N5O3/c20-11(17-14-15-8-16-18-14)6-3-7-19-12(21)9-4-1-2-5-10(9)13(19)22/h1-2,4-5,8H,3,6-7H2,(H2,15,16,17,18,20)
InChIKey KLTXHYVLQNCIBM-UHFFFAOYSA-N
Molecular Weight 299.290 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13350
Solvent DMSO-d6
Source Vendor ID: ZI/10010122; Lab Info: PLU; Lab Number: D005-2282