CID 2769670

2358-22-7

Structural Information

Molecular Formula
C7H2F13NO
SMILES
C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N
InChI
InChI=1S/C7H2F13NO/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H2,21,22)
InChIKey
SMJYTRJJHRJAED-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

40
Patents

362.9929 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.00018 163.1
[M+Na]+ 385.98212 172.0
[M-H]- 361.98562 148.8
[M+NH4]+ 381.02672 149.9
[M+K]+ 401.95606 169.3
[M+H-H2O]+ 345.99016 149.9
[M+HCOO]- 407.99110 163.5
[M+CH3COO]- 422.00675 216.3
[M+Na-2H]- 383.96757 165.7
[M]+ 362.99235 141.1
[M]- 362.99345 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

literature stripe

Patent stripe

patents stripe