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3-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(1H-pyrrol-2-yl)-propenone
SpectraBase Compound ID 6fMRFqxYu3o
InChI InChI=1S/C12H13N3O/c1-9-10(8-14-15(9)2)5-6-12(16)11-4-3-7-13-11/h3-8,13H,1-2H3/b6-5+
InChIKey OEATZINHWQHEQF-AATRIKPKSA-N
Mol Weight 215.26 g/mol
Molecular Formula C12H13N3O
Exact Mass 215.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZKA45Wz9E7
Name 3-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(1H-pyrrol-2-yl)-propenone
Alternate Name(s) (2E)-3-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(1H-pyrrol-2-yl)-2-propen-1-one (E)-3-(1,5-dimethyl-4-pyrazolyl)-1-(1H-pyrrol-2-yl)-2-propen-1-one (E)-3-(1,5-dimethylpyrazol-4-yl)-1-(1H-pyrrol-2-yl)prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O
InChI InChI=1S/C12H13N3O/c1-9-10(8-14-15(9)2)5-6-12(16)11-4-3-7-13-11/h3-8,13H,1-2H3/b6-5+
InChIKey OEATZINHWQHEQF-AATRIKPKSA-N
Molecular Weight 215.256 g/mol
SMILES [nH]1c(ccc1)C(\C=C\c1c([n](nc1)C)C)=O
SPLASH splash10-014i-9640000000-c88a270b64b6f44d56ac
Wiley ID 1461572