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3-t-butyl-4-(9-fluorenyl)-5-methyl-1H-pyrazole
SpectraBase Compound ID DAqa09sYHC9
InChI InChI=1S/C21H22N2/c1-13-18(20(23-22-13)21(2,3)4)19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h5-12,19H,1-4H3,(H,22,23)
InChIKey XRCSNCICIQFYQB-UHFFFAOYSA-N
Mol Weight 302.42 g/mol
Molecular Formula C21H22N2
Exact Mass 302.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88MKqpp27xC
Name 3-t-butyl-4-(9-fluorenyl)-5-methyl-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2
InChI InChI=1S/C21H22N2/c1-13-18(20(23-22-13)21(2,3)4)19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h5-12,19H,1-4H3,(H,22,23)
InChIKey XRCSNCICIQFYQB-UHFFFAOYSA-N
Molecular Weight 302.421 g/mol
SMILES [nH]1nc(c(c1C)C1c2c(cccc2)-c2c1cccc2)C(C)(C)C
SPLASH splash10-0udu-6489000000-405bf33940c12bffe679
Source of Spectrum AJ-61-1829-2
Synonyms 3-tert-Butyl-4-(9H-fluoren-9-yl)-5-methyl-1H-pyrazole
Wiley ID 1305228