CID 5357495

49764-30-9

Structural Information

Molecular Formula
C16H13N3
SMILES
CC1=CC2=C(C=C1C)N=C3C(=N2)C4=CC=CC=C4N3
InChI
InChI=1S/C16H13N3/c1-9-7-13-14(8-10(9)2)19-16-15(17-13)11-5-3-4-6-12(11)18-16/h3-8H,1-2H3,(H,18,19)
InChIKey
SCFUIWRRMXBZFO-UHFFFAOYSA-N
Compound name
2,3-dimethyl-6H-indolo[3,2-b]quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

247.11095 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.11823 156.6
[M+Na]+ 270.10017 170.5
[M-H]- 246.10367 159.3
[M+NH4]+ 265.14477 174.9
[M+K]+ 286.07411 162.7
[M+H-H2O]+ 230.10821 148.2
[M+HCOO]- 292.10915 176.3
[M+CH3COO]- 306.12480 169.5
[M+Na-2H]- 268.08562 165.6
[M]+ 247.11040 160.1
[M]- 247.11150 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.