CID 25595

P 1265

Structural Information

Molecular Formula
C16H16Cl2N4O2
SMILES
C1=CC(=C(C=C1Cl)Cl)CNC(=O)CCNNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C16H16Cl2N4O2/c17-13-2-1-12(14(18)9-13)10-20-15(23)5-8-21-22-16(24)11-3-6-19-7-4-11/h1-4,6-7,9,21H,5,8,10H2,(H,20,23)(H,22,24)
InChIKey
UFJAKDVTSZYIBI-UHFFFAOYSA-N
Compound name
N-[(2,4-dichlorophenyl)methyl]-3-[2-(pyridine-4-carbonyl)hydrazinyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.06503 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.07231 182.0
[M+Na]+ 389.05425 188.1
[M-H]- 365.05775 186.4
[M+NH4]+ 384.09885 193.3
[M+K]+ 405.02819 181.7
[M+H-H2O]+ 349.06229 174.1
[M+HCOO]- 411.06323 196.7
[M+CH3COO]- 425.07888 218.7
[M+Na-2H]- 387.03970 185.4
[M]+ 366.06448 184.8
[M]- 366.06558 184.8
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.