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1,3-Dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]-1H-pyrazole
SpectraBase Compound ID FF3iTpBLWXl
InChI InChI=1S/C13H13N3O2/c1-10-12(9-15(2)14-10)6-3-11-4-7-13(8-5-11)16(17)18/h3-9H,1-2H3/b6-3+
InChIKey JILDKKGLSSIUHB-ZZXKWVIFSA-N
Mol Weight 243.27 g/mol
Molecular Formula C13H13N3O2
Exact Mass 243.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D88gOF9glmt
Name 1,3-Dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]-1H-pyrazole
Alternate Name(s) 1,3-Dimethyl-4-[(E)-2-(4-nitrophenyl)ethenyl]pyrazole 1,3-Dimethyl-4-[(E)-2-(4-nitrophenyl)vinyl]pyrazole Pyrazole, 1,3-dimethyl-4-[2-(4-nitrophenyl)ethenyl]-
CAS Registry Number 84547-52-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O2
InChI InChI=1S/C13H13N3O2/c1-10-12(9-15(2)14-10)6-3-11-4-7-13(8-5-11)16(17)18/h3-9H,1-2H3/b6-3+
InChIKey JILDKKGLSSIUHB-ZZXKWVIFSA-N
Molecular Weight 243.266 g/mol
SMILES Cc1c(\C=C\c2ccc(N(=O)=O)cc2)c[n](n1)C
SPLASH splash10-0006-6950000000-f79a8f0afeb901362895
Source of Spectrum AD-0-2532-0
Wiley ID 1420545