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3-METHYL-1-PROPYNOYLPYRAZOLE
SpectraBase Compound ID KTBaAqRukwc
InChI InChI=1S/C7H6N2O/c1-3-7(10)9-5-4-6(2)8-9/h1,4-5H,2H3
InChIKey MULIKOSJSVLUFG-UHFFFAOYSA-N
Mol Weight 134.14 g/mol
Molecular Formula C7H6N2O
Exact Mass 134.048013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Epy2q35G3q
Name 3- and 5-methyl-1-propynoylpyrazole (65:35 mixture)
Alternate Name(s) 3-methyl-1-propynoylpyrazole 3-methyl-1-propioloyl-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
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Formula C7H6N2O
InChI InChI=1S/C7H6N2O/c1-3-7(10)9-5-4-6(2)8-9/h1,4-5H,2H3
InChIKey MULIKOSJSVLUFG-UHFFFAOYSA-N
Molecular Weight 134.138 g/mol
SMILES c1(n[n](cc1)C(C#C)=O)C
SPLASH splash10-0ue9-9700000000-960fb31c857192a65a76
Source of Spectrum B-47-991-0
Wiley ID 1134763