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3-Bromo-5-(2-methoxyphenyl)isothiazole-4-carbonitrile

View entire compound with spectra: 1 MS (GC)

3-Bromo-5-(2-methoxyphenyl)isothiazole-4-carbonitrile
SpectraBase Compound ID BJDZBqrLhib
InChI InChI=1S/C11H7BrN2OS/c1-15-9-5-3-2-4-7(9)10-8(6-13)11(12)14-16-10/h2-5H,1H3
InChIKey OMAWKRKHSGVUBD-UHFFFAOYSA-N
Mol Weight 295.15 g/mol
Molecular Formula C11H7BrN2OS
Exact Mass 293.946247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ev3E7E2VpsB
Name 3-Bromo-5-(2-methoxyphenyl)isothiazole-4-carbonitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7BrN2OS
InChI InChI=1S/C11H7BrN2OS/c1-15-9-5-3-2-4-7(9)10-8(6-13)11(12)14-16-10/h2-5H,1H3
InChIKey OMAWKRKHSGVUBD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200196m
Molecular Weight 295.154 g/mol
SMILES c1(c(Br)nsc1-c1ccccc1OC)C#N
SPLASH splash10-02u4-3980000000-896d63bbf7f34ea58c1d
Source of Spectrum A1-13-1510/SM5-2c
Wiley ID 1752951