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1-Nitroanthraquinone
SpectraBase Compound ID 4tuFRvtfCOt
InChI InChI=1S/C14H7NO4/c16-13-8-4-1-2-5-9(8)14(17)12-10(13)6-3-7-11(12)15(18)19/h1-7H
InChIKey YCANAXVBJKNANM-UHFFFAOYSA-N
Mol Weight 253.21 g/mol
Molecular Formula C14H7NO4
Exact Mass 253.037508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFyzAhn6PYx
Name 1-nitroanthracene-9,10-dione
Appearance Amorphous orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.037507705 u
Formula C14H7NO4
InChI InChI=1S/C14H7NO4/c16-13-8-4-1-2-5-9(8)14(17)12-10(13)6-3-7-11(12)15(18)19/h1-7H
InChIKey YCANAXVBJKNANM-UHFFFAOYSA-N
Instrument Name VG Micromass ZAB-2F
Ionization Type EI
Literature Reference DOI 10.1016/j.rechem.2023.100997
Molecular Weight 253.213 g/mol
Quality 105
Reported Formula C14H7NO4
SMILES C1=C(C2=C(C=C1)C(C1=C(C2=O)C=CC=C1)=O)[N+]([O-])=O
SPLASH splash10-0udi-0490000000-c14c5fd3e48eb1865955
Source of Spectrum REC-6-10-3e (DOI: 10.1016/j.rechem.2023.100997)
Wiley ID 1911868