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3-isopropyl-5-methyl-1H-pyrazole
SpectraBase Compound ID 7cJ5TQ4QBTt
InChI InChI=1S/C7H12N2/c1-5(2)7-4-6(3)8-9-7/h4-5H,1-3H3,(H,8,9)
InChIKey RFAYRFKDGUMREU-UHFFFAOYSA-N
Mol Weight 124.19 g/mol
Molecular Formula C7H12N2
Exact Mass 124.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKzsL8Y7U2B
Name 3-isopropyl-5-methyl-1H-pyrazole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N2
InChI InChI=1S/C7H12N2/c1-5(2)7-4-6(3)8-9-7/h4-5H,1-3H3,(H,8,9)
InChIKey RFAYRFKDGUMREU-UHFFFAOYSA-N
Molecular Weight 124.187 g/mol
SMILES [nH]1nc(cc1C(C)C)C
SPLASH splash10-0a4i-0900000000-61cc1d6a5dbce94e7f33
Source of Spectrum Y-38-122-6
Synonyms 5-isopropyl-3-methyl-1H-pyrazole 5-methyl-3-propan-2-yl-1H-pyrazole
Wiley ID 848319