CID 456722

N'-(2,2-dichloroacetyl)benzohydrazide

Structural Information

Molecular Formula
C9H8Cl2N2O2
SMILES
C1=CC=C(C=C1)C(=O)NNC(=O)C(Cl)Cl
InChI
InChI=1S/C9H8Cl2N2O2/c10-7(11)9(15)13-12-8(14)6-4-2-1-3-5-6/h1-5,7H,(H,12,14)(H,13,15)
InChIKey
DOOTWISQOYOCKS-UHFFFAOYSA-N
Compound name
N'-(2,2-dichloroacetyl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

245.99628 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.00356 149.6
[M+Na]+ 268.98550 156.5
[M-H]- 244.98900 152.6
[M+NH4]+ 264.03010 167.4
[M+K]+ 284.95944 152.2
[M+H-H2O]+ 228.99354 145.2
[M+HCOO]- 290.99448 164.7
[M+CH3COO]- 305.01013 192.4
[M+Na-2H]- 266.97095 153.5
[M]+ 245.99573 150.8
[M]- 245.99683 150.8
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

patents stripe