CID 5479913

70038-77-6

Structural Information

Molecular Formula
C17H15N3
SMILES
CC1=CC2=C(C=C1)NC3=NC4=C(C=C(C(=C4)C)C)N=C23
InChI
InChI=1S/C17H15N3/c1-9-4-5-13-12(6-9)16-17(19-13)20-15-8-11(3)10(2)7-14(15)18-16/h4-8H,1-3H3,(H,19,20)
InChIKey
GWXPMSIDYFWQCF-UHFFFAOYSA-N
Compound name
2,3,9-trimethyl-6H-indolo[3,2-b]quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1266 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.13388 162.2
[M+Na]+ 284.11582 176.5
[M-H]- 260.11932 165.1
[M+NH4]+ 279.16042 180.2
[M+K]+ 300.08976 168.5
[M+H-H2O]+ 244.12386 153.8
[M+HCOO]- 306.12480 181.4
[M+CH3COO]- 320.14045 174.9
[M+Na-2H]- 282.10127 169.8
[M]+ 261.12605 166.4
[M]- 261.12715 166.4
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.