CID 60784

Mivazerol

Structural Information

Molecular Formula
C11H11N3O2
SMILES
C1=CC(=C(C(=C1)C(=O)N)O)CC2=CN=CN2
InChI
InChI=1S/C11H11N3O2/c12-11(16)9-3-1-2-7(10(9)15)4-8-5-13-6-14-8/h1-3,5-6,15H,4H2,(H2,12,16)(H,13,14)
InChIKey
RLHGFJMGWQXPBW-UHFFFAOYSA-N
Compound name
2-hydroxy-3-(1H-imidazol-5-ylmethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

34
References

14837
Patents

217.08513 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.09241 146.7
[M+Na]+ 240.07435 154.5
[M-H]- 216.07785 148.4
[M+NH4]+ 235.11895 162.3
[M+K]+ 256.04829 150.1
[M+H-H2O]+ 200.08239 139.0
[M+HCOO]- 262.08333 167.4
[M+CH3COO]- 276.09898 184.1
[M+Na-2H]- 238.05980 149.8
[M]+ 217.08458 143.5
[M]- 217.08568 143.5
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

patents stripe