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2-Benzyl-3-(3-hydroxypropylamino)-5-nitro-2H-indazole
SpectraBase Compound ID CxdFDBktpTi
InChI InChI=1S/C17H18N4O3/c22-10-4-9-18-17-15-11-14(21(23)24)7-8-16(15)19-20(17)12-13-5-2-1-3-6-13/h1-3,5-8,11,18,22H,4,9-10,12H2
InChIKey VOMHTYPFSOLBJX-UHFFFAOYSA-N
Mol Weight 326.36 g/mol
Molecular Formula C17H18N4O3
Exact Mass 326.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cu2xZ9EFUP7
Name 2-Benzyl-3-(3-hydroxypropylamino)-5-nitro-2H-indazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N4O3
InChI InChI=1S/C17H18N4O3/c22-10-4-9-18-17-15-11-14(21(23)24)7-8-16(15)19-20(17)12-13-5-2-1-3-6-13/h1-3,5-8,11,18,22H,4,9-10,12H2
InChIKey VOMHTYPFSOLBJX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201800084
Molecular Weight 326.356 g/mol
SMILES N(c1c2c(n[n]1Cc1ccccc1)ccc(c2)[N+]([O-])=O)CCCO
SPLASH splash10-004i-0139000000-92631f7ec853134a0274
Source of Spectrum CMC-13-1256-32
Synonyms 3-((2-benzyl-5-nitro-2H-indazol-3-yl)amino)propan-1-ol
Wiley ID 1812820