CID 12604750

60308-67-0

Structural Information

Molecular Formula
C9H2F17NO3
SMILES
C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)N
InChI
InChI=1S/C9H2F17NO3/c10-2(1(27)28,5(14,15)16)29-9(25,26)4(13,7(20,21)22)30-8(23,24)3(11,12)6(17,18)19/h(H2,27,28)
InChIKey
LEBNQGASTHOFJF-UHFFFAOYSA-N
Compound name
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

494.97632 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 495.98360 157.9
[M+Na]+ 517.96554 164.7
[M-H]- 493.96904 168.3
[M+NH4]+ 513.01014 167.8
[M+K]+ 533.93948 170.9
[M+H-H2O]+ 477.97358 147.5
[M+HCOO]- 539.97452 176.0
[M+CH3COO]- 553.99017 235.7
[M+Na-2H]- 515.95099 158.2
[M]+ 494.97577 154.3
[M]- 494.97687 154.3
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