2-Imino-1-isobutyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carbonitrile

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Systematic / IUPAC Name: 2-Imino-1-isobutyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile

ID: Reference4689

Other Names: 2-Imino-1-isobutyl-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carbonitrile;
6-Imino-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile

Formula: C16H15N5O

Spectral Data

2-Imino-1-isobutyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carbonitrile 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 4/27/2016 12:23:52 PM
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Identificators

InChI InChI=1S/C16H15N5O/c1-10(2)9-21-14(18)11(8-17)7-12-15(21)19-13-5-3-4-6-20(13)16(12)22/h3-7,10,18H,9H2,1-2H3
InChI Key YELKTKAMCGCJRL-UHFFFAOYSA-N
Canonical SMILES CC(C)CN1C2=C(C=C(C1=N)C#N)C(=O)N3C=CC=CC3=N2
CAS
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Other Names 2-Imino-1-isobutyl-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carbonitrile;
6-Imino-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile

In Other Databases

PubChem 704580
ChemSpider 17781007