CID 3061671

Brn 5533020

Structural Information

Molecular Formula
C10H11N3O
SMILES
C1CNC2=NC3=C(N2C1)C=CC(=C3)O
InChI
InChI=1S/C10H11N3O/c14-7-2-3-9-8(6-7)12-10-11-4-1-5-13(9)10/h2-3,6,14H,1,4-5H2,(H,11,12)
InChIKey
WCCGRYZDJUXZKG-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.09021 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.097486 139.0
[M+Na]+ 212.079428 148.8
[M-H]- 188.082934 138.1
[M+NH4]+ 207.124033 157.4
[M+K]+ 228.053368 143.7
[M+H-H2O]+ 172.087470 131.6
[M+HCOO]- 234.088411 155.6
[M+CH3COO]- 248.104061 151.0
[M+Na-2H]- 210.064876 146.6
[M]+ 189.08966142 136.4
[M]- 189.09075858 136.4
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.