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JTBSTOBVBOSVAW-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

JTBSTOBVBOSVAW-UHFFFAOYSA-N
SpectraBase Compound ID 5cbYd2aqnxb
InChI InChI=1S/C9H11N7O/c1-15(2)8-10-5-4-6(12-9(17)11-5)14-16(3)7(4)13-8/h1-3H3,(H2,10,11,12,13,14,17)
InChIKey JTBSTOBVBOSVAW-UHFFFAOYSA-N
Mol Weight 233.23 g/mol
Molecular Formula C9H11N7O
Exact Mass 233.102508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAPkMlUnRsv
Name 7-Dimethylamino-1-methyl-1,3,5-trihydro-1,2,3,5,6,8-hexaazaacenaphylen-4(3,5H)-one
Alternate Name(s) 7-(dimethylamino)-1-methyl-1,5-dihydro-1,2,3,5,6,8-hexaazaacenaphthylen-4(3H)-one 7-Dimethylamino-1-methyl-1,5-dihydro-3H-1,2,3,5,6,8-hexaaza-acenaphthylen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N7O
InChI InChI=1S/C9H11N7O/c1-15(2)8-10-5-4-6(12-9(17)11-5)14-16(3)7(4)13-8/h1-3H3,(H2,10,11,12,13,14,17)
InChIKey JTBSTOBVBOSVAW-UHFFFAOYSA-N
Molecular Weight 233.235 g/mol
SMILES N1C(Nc2c3c1n[n](c3nc(N(C)C)n2)C)=O
SPLASH splash10-0536-4390000000-c84d5d2d3eff8847fe38
Source of Spectrum H1-51-263-12
Wiley ID 817003