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1-(4-Methoxy-2-neopentylphenyl)-5-methyl-1H-pyrazole
SpectraBase Compound ID E49FEXP6XCU
InChI InChI=1S/C16H22N2O/c1-12-8-9-17-18(12)15-7-6-14(19-5)10-13(15)11-16(2,3)4/h6-10H,11H2,1-5H3
InChIKey IYUCOCKUWIUOIZ-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C16H22N2O
Exact Mass 258.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AEOpeCVm54
Name 1-(4-Methoxy-2-neopentylphenyl)-5-methyl-1H-pyrazole
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O
InChI InChI=1S/C16H22N2O/c1-12-8-9-17-18(12)15-7-6-14(19-5)10-13(15)11-16(2,3)4/h6-10H,11H2,1-5H3
InChIKey IYUCOCKUWIUOIZ-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.202007144
Molecular Weight 258.365 g/mol
Reported Formula C16H22N2O
SMILES c1(c(ccc(c1)OC)-[n]1c(ccn1)C)CC(C)(C)C
SPLASH splash10-0f76-1490000000-12ede56ec92169324d1c
Source of Spectrum ACI-59-SM30-6ii
Wiley ID 1858321