CID 71143

Mopidralazine hydrochloride

Structural Information

Molecular Formula
C14H19N5O
SMILES
CC1=CC=C(N1NC2=NN=C(C=C2)N3CCOCC3)C
InChI
InChI=1S/C14H19N5O/c1-11-3-4-12(2)19(11)17-13-5-6-14(16-15-13)18-7-9-20-10-8-18/h3-6H,7-10H2,1-2H3,(H,15,17)
InChIKey
JBVCSNJKVNKDHK-UHFFFAOYSA-N
Compound name
N-(2,5-dimethylpyrrol-1-yl)-6-morpholin-4-ylpyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

44
Patents

273.15897 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.16625 165.4
[M+Na]+ 296.14819 172.2
[M-H]- 272.15169 170.2
[M+NH4]+ 291.19279 175.9
[M+K]+ 312.12213 168.7
[M+H-H2O]+ 256.15623 154.1
[M+HCOO]- 318.15717 182.4
[M+CH3COO]- 332.17282 175.4
[M+Na-2H]- 294.13364 168.5
[M]+ 273.15842 162.8
[M]- 273.15952 162.8
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