CID 135452472

Einecs 264-072-7

Structural Information

Molecular Formula
C15H10N4O
SMILES
C1=CC2=C(NC(=C2C=C1)O)N=C3N=C4C=CC=CC4=N3
InChI
InChI=1S/C15H10N4O/c20-14-10-6-2-1-5-9(10)13(18-14)19-15-16-11-7-3-4-8-12(11)17-15/h1-8,18,20H
InChIKey
RCQLCKGWGZYBOL-UHFFFAOYSA-N
Compound name
3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

0
Patents

262.08545 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.09273 156.5
[M+Na]+ 285.07467 172.1
[M+NH4]+ 280.11927 164.8
[M+K]+ 301.04861 168.1
[M-H]- 261.07817 160.2
[M+Na-2H]- 283.06012 165.2
[M]+ 262.08490 159.7
[M]- 262.08600 159.7
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.