CID 121197

Brn 1374261

Structural Information

Molecular Formula
C9H12Cl2N2O2
SMILES
C1=COC(=C1)C(=O)NN(CCCl)CCCl
InChI
InChI=1S/C9H12Cl2N2O2/c10-3-5-13(6-4-11)12-9(14)8-2-1-7-15-8/h1-2,7H,3-6H2,(H,12,14)
InChIKey
GMMSSVMQNUABLT-UHFFFAOYSA-N
Compound name
N',N'-bis(2-chloroethyl)furan-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.02759 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.03487 157.0
[M+Na]+ 273.01681 163.7
[M-H]- 249.02031 161.5
[M+NH4]+ 268.06141 175.6
[M+K]+ 288.99075 161.1
[M+H-H2O]+ 233.02485 151.6
[M+HCOO]- 295.02579 173.5
[M+CH3COO]- 309.04144 196.2
[M+Na-2H]- 271.00226 160.7
[M]+ 250.02704 162.2
[M]- 250.02814 162.2
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.