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2-hexahydro-1H-azepin-1-yl-2-oxo-N'-[(E)-2-thienylmethylidene]acetohydrazide
SpectraBase Compound ID 1nV4NgtQGJ7
InChI InChI=1S/C13H17N3O2S/c17-12(15-14-10-11-6-5-9-19-11)13(18)16-7-3-1-2-4-8-16/h5-6,9-10H,1-4,7-8H2,(H,15,17)/b14-10+
InChIKey ZUNUPNCQVAIXSJ-GXDHUFHOSA-N
Mol Weight 279.36 g/mol
Molecular Formula C13H17N3O2S
Exact Mass 279.104148 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fy9ekib1sex
Name 2-hexahydro-1H-azepin-1-yl-2-oxo-N'-[(E)-2-thienylmethylidene]acetohydrazide
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/C13H17N3O2S/c17-12(15-14-10-11-6-5-9-19-11)13(18)16-7-3-1-2-4-8-16/h5-6,9-10H,1-4,7-8H2,(H,15,17)/b14-10+
InChIKey ZUNUPNCQVAIXSJ-GXDHUFHOSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_993
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/7119935; Labnumber: LD-0800904; IOH_ID: IOH-000994
Synonyms 2-hexahydro-1H-azepin-1-yl-2-oxo-N'-[2-thienylmethylidene]acetohydrazide
Temperature 303 °C