1-Acetyl-3-(pyridin-3-ylmethylene)tetrahydropyrazine-2,5-dione

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Systematic / IUPAC Name: (3Z)-1-Acetyl-3-(3-pyridinylmethylene)-2,5-piperazinedione

ID: Reference6430

Other Names: (3Z)-1-Acetyl-3-(pyridin-3-ylmethylidene)piperazine-2,5-dione;
2,5-Piperazinedione, 1-acetyl-3-(3-pyridinylmethylene)-, (3Z)-

Formula: C12H11N3O3

Spectral Data

1-Acetyl-3-(pyridin-3-ylmethylene)tetrahydropyrazine-2,5-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 3/2/2017 1:31:18 PM
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Identificators

InChI InChI=1S/C12H11N3O3/c1-8(16)15-7-11(17)14-10(12(15)18)5-9-3-2-4-13-6-9/h2-6H,7H2,1H3,(H,14,17)/b10-5-
InChI Key NJDPZKFXNDIJSY-YHYXMXQVSA-N
Canonical SMILES CC(=O)N1CC(=O)NC(=CC2=CN=CC=C2)C1=O
CAS
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Other Names (3Z)-1-Acetyl-3-(pyridin-3-ylmethylidene)piperazine-2,5-dione;
2,5-Piperazinedione, 1-acetyl-3-(3-pyridinylmethylene)-, (3Z)-

In Other Databases

PubChem 5716796
ChemSpider 4653652