CID 71382954

62765-24-6

Structural Information

Molecular Formula
C10H6F7N
SMILES
C1=CC=C(C=C1)N=CC(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H6F7N/c11-8(12,9(13,14)10(15,16)17)6-18-7-4-2-1-3-5-7/h1-6H
InChIKey
ZLEJZFMXNQLLHM-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,4-heptafluoro-N-phenylbutan-1-imine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

273.03885 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.04613 151.1
[M+Na]+ 296.02807 159.8
[M-H]- 272.03157 147.2
[M+NH4]+ 291.07267 167.3
[M+K]+ 312.00201 156.1
[M+H-H2O]+ 256.03611 139.6
[M+HCOO]- 318.03705 165.6
[M+CH3COO]- 332.05270 200.9
[M+Na-2H]- 294.01352 157.3
[M]+ 273.03830 141.1
[M]- 273.03940 141.1
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.