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4-[4-(hexahydro-1H-azepin-1-ylcarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-ylamine
SpectraBase Compound ID EAWHXNDr2pf
InChI InChI=1S/C12H17N7O2/c1-8-9(12(20)18-6-4-2-3-5-7-18)14-17-19(8)11-10(13)15-21-16-11/h2-7H2,1H3,(H2,13,15)
InChIKey ROJNXRWXKXAUPJ-UHFFFAOYSA-N
Mol Weight 291.31 g/mol
Molecular Formula C12H17N7O2
Exact Mass 291.144373 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fcsdb6iA06
Name 4-[4-(hexahydro-1H-azepin-1-ylcarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-ylamine
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/C12H17N7O2/c1-8-9(12(20)18-6-4-2-3-5-7-18)14-17-19(8)11-10(13)15-21-16-11/h2-7H2,1H3,(H2,13,15)
InChIKey ROJNXRWXKXAUPJ-UHFFFAOYSA-N
NMR Offset 18.4928
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_380
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: ZI/8097389; Labnumber: VUR-0003554; IOH_ID: IOH-000381
Synonyms 4-[4-(hexahydro-1H-azepin-1-ylcarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine
Temperature 297 °C