CID 278869

Cun6qh9iol

Structural Information

Molecular Formula
C14H10N4
SMILES
CC1=CC2=C(C=C1)N3C(=N2)C4=CC=CC=C4N=N3
InChI
InChI=1S/C14H10N4/c1-9-6-7-13-12(8-9)15-14-10-4-2-3-5-11(10)16-17-18(13)14/h2-8H,1H3
InChIKey
PZFOUALESMCYKL-UHFFFAOYSA-N
Compound name
10-methylbenzimidazolo[1,2-c][1,2,3]benzotriazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.09055 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.09783 151.9
[M+Na]+ 257.07977 166.1
[M-H]- 233.08327 154.4
[M+NH4]+ 252.12437 169.6
[M+K]+ 273.05371 159.3
[M+H-H2O]+ 217.08781 142.3
[M+HCOO]- 279.08875 172.2
[M+CH3COO]- 293.10440 165.1
[M+Na-2H]- 255.06522 162.8
[M]+ 234.09000 156.4
[M]- 234.09110 156.4
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.