CID 2396841

55338-12-0

Structural Information

Molecular Formula
C16H13N3
SMILES
CC1=NC2=CC=CC=C2C3=C(C4=CC=CC=C4N13)N
InChI
InChI=1S/C16H13N3/c1-10-18-13-8-4-2-6-11(13)16-15(17)12-7-3-5-9-14(12)19(10)16/h2-9H,17H2,1H3
InChIKey
JXDDRDSPPIIJOQ-UHFFFAOYSA-N
Compound name
6-methylindolo[1,2-c]quinazolin-12-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

247.11095 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.11823 154.3
[M+Na]+ 270.10017 172.2
[M+NH4]+ 265.14477 164.8
[M+K]+ 286.07411 164.5
[M-H]- 246.10367 159.2
[M+Na-2H]- 268.08562 162.7
[M]+ 247.11040 158.5
[M]- 247.11150 158.5
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.