CID 3080422

Brn 4331675

Structural Information

Molecular Formula
C16H13Cl3N2O3
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(=O)NNC(=O)CCl)O)Cl
InChI
InChI=1S/C16H13Cl3N2O3/c17-9-14(22)20-21-15(23)16(24,10-1-5-12(18)6-2-10)11-3-7-13(19)8-4-11/h1-8,24H,9H2,(H,20,22)(H,21,23)
InChIKey
SGDLEHABJJYDOB-UHFFFAOYSA-N
Compound name
N'-(2-chloroacetyl)-2,2-bis(4-chlorophenyl)-2-hydroxyacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.99918 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.00646 182.1
[M+Na]+ 408.98840 189.1
[M-H]- 384.99190 186.0
[M+NH4]+ 404.03300 194.0
[M+K]+ 424.96234 182.5
[M+H-H2O]+ 368.99644 177.2
[M+HCOO]- 430.99738 189.1
[M+CH3COO]- 445.01303 215.1
[M+Na-2H]- 406.97385 184.4
[M]+ 385.99863 184.8
[M]- 385.99973 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.