CID 9802264

Losartan carboxaldehyde

Structural Information

Molecular Formula
C22H21ClN6O
SMILES
CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C=O)Cl
InChI
InChI=1S/C22H21ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,14H,2-3,8,13H2,1H3,(H,25,26,27,28)
InChIKey
FQZSMTSTFMNWQF-UHFFFAOYSA-N
Compound name
2-butyl-5-chloro-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

91
Patents

420.14655 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.15383 200.1
[M+Na]+ 443.13577 210.9
[M-H]- 419.13927 205.0
[M+NH4]+ 438.18037 205.6
[M+K]+ 459.10971 200.9
[M+H-H2O]+ 403.14381 186.6
[M+HCOO]- 465.14475 212.7
[M+CH3COO]- 479.16040 208.2
[M+Na-2H]- 441.12122 198.3
[M]+ 420.14600 205.0
[M]- 420.14710 205.0
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.