CID 3075150

172701-53-0

Structural Information

Molecular Formula
C17H15ClN6O2
SMILES
COC1=C(N(N=C1C(=O)NN)C2=CC(=CC=C2)Cl)N=NC3=CC=CC=C3
InChI
InChI=1S/C17H15ClN6O2/c1-26-15-14(17(25)20-19)23-24(13-9-5-6-11(18)10-13)16(15)22-21-12-7-3-2-4-8-12/h2-10H,19H2,1H3,(H,20,25)
InChIKey
BXVWTJLQSTXFRG-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-4-methoxy-5-phenyldiazenylpyrazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.0945 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.10178 185.2
[M+Na]+ 393.08372 193.4
[M-H]- 369.08722 195.4
[M+NH4]+ 388.12832 197.1
[M+K]+ 409.05766 188.4
[M+H-H2O]+ 353.09176 174.2
[M+HCOO]- 415.09270 209.5
[M+CH3COO]- 429.10835 227.0
[M+Na-2H]- 391.06917 189.1
[M]+ 370.09395 189.0
[M]- 370.09505 189.0
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.