SpectraBase Spectrum ID |
32KrZqx01ex |
Name |
N-(3,4-dimethylphenyl)-7-hexahydro-1H-azepin-1-yl-4-nitro-2,1,3-benzoxadiazol-5-amine |
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/C20H23N5O3/c1-13-7-8-15(11-14(13)2)21-16-12-17(24-9-5-3-4-6-10-24)18-19(23-28-22-18)20(16)25(26)27/h7-8,11-12,21H,3-6,9-10H2,1-2H3 |
InChIKey |
GCLCRONPJXCBRX-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI-VK_18310_14152 |
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: 200984; Labnumber: TKL2-185; VK_ID: VK-014157 |
Synonyms |
N-(3,4-dimethylphenyl)-N-(7-hexahydro-1H-azepin-1-yl-4-nitro-2,1,3-benzoxadiazol-5-yl)amine |
Temperature |
315 °C |