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1-(2-Acetoxyethyl)-2-benzyl-5-nitro-1,2-dihydro-3H-indazol-3-one
SpectraBase Compound ID IPyghoWPMOb
InChI InChI=1S/C18H17N3O5/c1-13(22)26-10-9-19-17-8-7-15(21(24)25)11-16(17)18(23)20(19)12-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3
InChIKey GRCYUZFKNZGSHX-UHFFFAOYSA-N
Mol Weight 355.35 g/mol
Molecular Formula C18H17N3O5
Exact Mass 355.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IROZCG6E8e
Name 1-(2-Acetoxyethyl)-2-benzyl-5-nitro-1,2-dihydro-3H-indazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.116820654 u
Formula C18H17N3O5
InChI InChI=1S/C18H17N3O5/c1-13(22)26-10-9-19-17-8-7-15(21(24)25)11-16(17)18(23)20(19)12-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3
InChIKey GRCYUZFKNZGSHX-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 355.350 g/mol
Quality 140
SMILES C(C)(=O)OCCN1N(C(C2=C1C=CC(=C2)[N+](=O)[O-])=O)CC1=CC=CC=C1
SPLASH splash10-0a4i-0119000000-364424e4214d303ff2ea
Source of Spectrum ES2614131A1
Wiley ID 1894585