2-Acetyl-4-nitroindane-1,3-dione

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Systematic / IUPAC Name: 2-Acetyl-4-nitro-1H-indene-1,3(2H)-dione

ID: Reference6749

Other Names: 1H-Indene-1,3(2H)-dione, 2-acetyl-4-nitro-;
2-Acetyl-4-nitro 1,3-indanedione;
2-Acetyl-4-nitro-1,3-dioxo-2-hydrocyclopenta[2,1-a]benzene;
2-Acetyl-4-nitro-2H-indene-1,3-dione;
2-Acetyl-4-nitroindan-1,3-dione

Formula: C11H7NO5

Spectral Data

2-Acetyl-4-nitroindane-1,3-dione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/28/2017 8:23:13 AM
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Identificators

InChI InChI=1S/C11H7NO5/c1-5(13)8-10(14)6-3-2-4-7(12(16)17)9(6)11(8)15/h2-4,8H,1H3
InChI Key OSZUSQXEYYPINX-UHFFFAOYSA-N
Canonical SMILES
CAS 25125046
Splash
Other Names 1H-Indene-1,3(2H)-dione, 2-acetyl-4-nitro-;
2-Acetyl-4-nitro 1,3-indanedione;
2-Acetyl-4-nitro-1,3-dioxo-2-hydrocyclopenta[2,1-a]benzene;
2-Acetyl-4-nitro-2H-indene-1,3-dione;
2-Acetyl-4-nitroindan-1,3-dione;
2-Acetyl-4-nitroindene-1,3-dione

In Other Databases

ChemSpider 2016957
PubChem 2735262