CID 10375475

3-amino-6,7-dimethyl-quinoxaline-2-carbonitrile

Structural Information

Molecular Formula
C11H10N4
SMILES
CC1=CC2=C(C=C1C)N=C(C(=N2)C#N)N
InChI
InChI=1S/C11H10N4/c1-6-3-8-9(4-7(6)2)15-11(13)10(5-12)14-8/h3-4H,1-2H3,(H2,13,15)
InChIKey
YKUZCQAIUNRBLE-UHFFFAOYSA-N
Compound name
3-amino-6,7-dimethylquinoxaline-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

198.09055 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.09783 144.9
[M+Na]+ 221.07977 157.1
[M-H]- 197.08327 146.1
[M+NH4]+ 216.12437 160.7
[M+K]+ 237.05371 152.0
[M+H-H2O]+ 181.08781 131.0
[M+HCOO]- 243.08875 162.6
[M+CH3COO]- 257.10440 156.2
[M+Na-2H]- 219.06522 150.9
[M]+ 198.09000 139.7
[M]- 198.09110 139.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.