CID 3075149

172701-52-9

Structural Information

Molecular Formula
C19H20ClN7O2
SMILES
CN(C)C1=CC=C(C=C1)N=NC2=C(C(=NN2C3=CC(=CC=C3)Cl)C(=O)NN)OC
InChI
InChI=1S/C19H20ClN7O2/c1-26(2)14-9-7-13(8-10-14)23-24-18-17(29-3)16(19(28)22-21)25-27(18)15-6-4-5-12(20)11-15/h4-11H,21H2,1-3H3,(H,22,28)
InChIKey
WFCKSTRFBKQMSO-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-5-[[4-(dimethylamino)phenyl]diazenyl]-4-methoxypyrazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

413.1367 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.14398 199.2
[M+Na]+ 436.12592 206.5
[M-H]- 412.12942 210.9
[M+NH4]+ 431.17052 209.8
[M+K]+ 452.09986 202.8
[M+H-H2O]+ 396.13396 187.7
[M+HCOO]- 458.13490 224.3
[M+CH3COO]- 472.15055 242.5
[M+Na-2H]- 434.11137 201.3
[M]+ 413.13615 204.8
[M]- 413.13725 204.8
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.