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4-(2-bromo-4-methylphenyl)-5-[(1R,2R)-2-phenylcyclopropyl]-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID 1WdtwGLfXeQ
InChI InChI=1S/C18H16BrN3S/c1-11-7-8-16(15(19)9-11)22-17(20-21-18(22)23)14-10-13(14)12-5-3-2-4-6-12/h2-9,13-14H,10H2,1H3,(H,21,23)
InChIKey WIAZWOYOSAORQE-UHFFFAOYSA-N
Mol Weight 386.31 g/mol
Molecular Formula C18H16BrN3S
Exact Mass 385.024832 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AtIsap73zOy
Name 4-(2-bromo-4-methylphenyl)-5-[(1R,2R)-2-phenylcyclopropyl]-4H-1,2,4-triazol-3-yl hydrosulfide
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/C18H16BrN3S/c1-11-7-8-16(15(19)9-11)22-17(20-21-18(22)23)14-10-13(14)12-5-3-2-4-6-12/h2-9,13-14H,10H2,1H3,(H,21,23)
InChIKey WIAZWOYOSAORQE-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2541
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: D03624; Labnumber: NCOBK-0134; SBI_ID: SBI-002543
Synonyms 4-(2-bromo-4-methylphenyl)-5-[(1R,2R)-2-phenylcyclopropyl]-4H-1,2,4-triazole-3-thiol4-(2-bromo-4-methylphenyl)-5-[2-phenylcyclopropyl]-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C