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5-(3-Bromophenyl)-3-(methylsulfanyl)-1H-pyrazole
SpectraBase Compound ID 1eI5yI61f9U
InChI InChI=1S/C10H9BrN2S/c1-14-10-6-9(12-13-10)7-3-2-4-8(11)5-7/h2-6H,1H3,(H,12,13)
InChIKey URJSEZRPXPILEE-UHFFFAOYSA-N
Mol Weight 269.16 g/mol
Molecular Formula C10H9BrN2S
Exact Mass 267.966982 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1wPPnDXKsq
Name 5-(3-Bromophenyl)-3-(methylsulfanyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9BrN2S
InChI InChI=1S/C10H9BrN2S/c1-14-10-6-9(12-13-10)7-3-2-4-8(11)5-7/h2-6H,1H3,(H,12,13)
InChIKey URJSEZRPXPILEE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201300070
Molecular Weight 269.160 g/mol
SMILES [nH]1c(cc(n1)SC)-c1cccc(c1)Br
SPLASH splash10-014r-4290000000-654052e6e585a3371f31
Source of Spectrum H-96-2243-2g
Synonyms 5-(3-bromophenyl)-3-(methylthio)-1H-pyrazole
Wiley ID 1784646