CID 36412

2-benzoyl-1,1-bis(2-chloroethyl)hydrazine

Structural Information

Molecular Formula
C11H14Cl2N2O
SMILES
C1=CC=C(C=C1)C(=O)NN(CCCl)CCCl
InChI
InChI=1S/C11H14Cl2N2O/c12-6-8-15(9-7-13)14-11(16)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,14,16)
InChIKey
BHABEVYEURFFCY-UHFFFAOYSA-N
Compound name
N',N'-bis(2-chloroethyl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.0483 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.055576 157.2
[M+Na]+ 283.037518 163.4
[M-H]- 259.041024 160.8
[M+NH4]+ 278.082123 175.0
[M+K]+ 299.011458 159.0
[M+H-H2O]+ 243.045560 151.7
[M+HCOO]- 305.046501 173.4
[M+CH3COO]- 319.062151 200.1
[M+Na-2H]- 281.022966 161.4
[M]+ 260.04775142 160.8
[M]- 260.04884858 160.8
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.