CID 55279040

1955548-94-3

Structural Information

Molecular Formula
C7H6F2N2O2
SMILES
C1=CC(=C2C(=C1)OC(O2)(F)F)NN
InChI
InChI=1S/C7H6F2N2O2/c8-7(9)12-5-3-1-2-4(11-10)6(5)13-7/h1-3,11H,10H2
InChIKey
XURBLZHFBJCQSM-UHFFFAOYSA-N
Compound name
(2,2-difluoro-1,3-benzodioxol-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

188.03973 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.047006 131.5
[M+Na]+ 211.028948 141.4
[M-H]- 187.032454 135.0
[M+NH4]+ 206.073553 152.7
[M+K]+ 227.002888 141.0
[M+H-H2O]+ 171.036990 125.0
[M+HCOO]- 233.037931 153.7
[M+CH3COO]- 247.053581 183.7
[M+Na-2H]- 209.014396 140.6
[M]+ 188.03918142 129.4
[M]- 188.04027858 129.4
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