CID 9603567

932710-52-6

Structural Information

Molecular Formula
C11H8F5NO
SMILES
C/C=C/C=N/OCC1=C(C(=C(C(=C1F)F)F)F)F
InChI
InChI=1S/C11H8F5NO/c1-2-3-4-17-18-5-6-7(12)9(14)11(16)10(15)8(6)13/h2-4H,5H2,1H3/b3-2+,17-4+
InChIKey
QNPFFCQTVXPCLD-GFJWLWTISA-N
Compound name
(E,E)-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]but-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.0526 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.05988 166.3
[M+Na]+ 288.04182 173.6
[M+NH4]+ 283.08642 169.4
[M+K]+ 304.01576 167.4
[M-H]- 264.04532 161.8
[M+Na-2H]- 286.02727 167.5
[M]+ 265.05205 165.6
[M]- 265.05315 165.6
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.