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2-[4-(5-Nitro-1H-benzimidazol-2-yl)-1-phenyl-1H-pyrazol-3-yl]phenol
SpectraBase Compound ID 2NnBJqWcDC2
InChI InChI=1S/C22H15N5O3/c28-20-9-5-4-8-16(20)21-17(13-26(25-21)14-6-2-1-3-7-14)22-23-18-11-10-15(27(29)30)12-19(18)24-22/h1-13,28H,(H,23,24)
InChIKey NZBKGPFZARFSFX-UHFFFAOYSA-N
Mol Weight 397.39 g/mol
Molecular Formula C22H15N5O3
Exact Mass 397.117489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39fG2ELz7QG
Name 2-[4-(5-Nitro-1H-benzimidazol-2-yl)-1-phenyl-1H-pyrazol-3-yl]phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15N5O3
InChI InChI=1S/C22H15N5O3/c28-20-9-5-4-8-16(20)21-17(13-26(25-21)14-6-2-1-3-7-14)22-23-18-11-10-15(27(29)30)12-19(18)24-22/h1-13,28H,(H,23,24)
InChIKey NZBKGPFZARFSFX-UHFFFAOYSA-N
Instrument Name Finnigan
Ionization Type EI
Literature Reference DOI 10.1002/jhet.1506
Molecular Weight 397.394 g/mol
SMILES [nH]1c(-c2c(-c3c(cccc3)O)n[n](c2)-c2ccccc2)nc2cc([N+](=O)[O-])ccc12
SPLASH splash10-03dj-0936000000-3c2bed254705747b0726
Source of Spectrum Y-53-1355-6j
Wiley ID 1876583