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3,5-Dimethyl-1-phenyl-1H-pyrazole
SpectraBase Compound ID 1qjKNSPIxU3
InChI InChI=1S/C11H12N2/c1-9-8-10(2)13(12-9)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey ULPMPUPEFBDQQA-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C11H12N2
Exact Mass 172.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J44Vjc55TMX
Name 3,5-Dimethyl-1-phenyl-1H-pyrazole
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.100048394 u
Formula C11H12N2
InChI InChI=1S/C11H12N2/c1-9-8-10(2)13(12-9)11-6-4-3-5-7-11/h3-8H,1-2H3
InChIKey ULPMPUPEFBDQQA-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 172.231 g/mol
Quality 39
SMILES CC1=CC(=NN1C1=CC=CC=C1)C
SPLASH splash10-0a4i-0900000000-89005e083c68a2e19bc1
Source of Spectrum ACI-56-SM14-1ab (DOI: 10.1002/anie.201612565)
Wiley ID 1895501