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5H-1,2,4-Triazolo[4,3-a]azepine, 3-[(4-bromophenoxy)methyl]-6,7,8,9-tetrahydro-
SpectraBase Compound ID 4ZtYt3KyQlU
InChI InChI=1S/C14H16BrN3O/c15-11-5-7-12(8-6-11)19-10-14-17-16-13-4-2-1-3-9-18(13)14/h5-8H,1-4,9-10H2
InChIKey XMIXCUZQEXANIC-UHFFFAOYSA-N
Mol Weight 322.21 g/mol
Molecular Formula C14H16BrN3O
Exact Mass 321.047675 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 85bR3OKLLOM
Name 4-bromophenyl 6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl ether
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/C14H16BrN3O/c15-11-5-7-12(8-6-11)19-10-14-17-16-13-4-2-1-3-9-18(13)14/h5-8H,1-4,9-10H2
InChIKey XMIXCUZQEXANIC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15230
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: 987/00001569; Labnumber: 987/00001569218818; VK_ID: VK-015235
Synonyms 3-[(4-bromophenoxy)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Temperature 318 °C