CID 9793785

1,1,2,3,3-pentafluoropropane

Structural Information

Molecular Formula
C3H3F5
SMILES
C(C(F)F)(C(F)F)F
InChI
InChI=1S/C3H3F5/c4-1(2(5)6)3(7)8/h1-3H
InChIKey
MWDWMQNTNBHJEI-UHFFFAOYSA-N
Compound name
1,1,2,3,3-pentafluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8639
Patents

134.01549 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.022766 117.8
[M+Na]+ 157.004708 125.6
[M-H]- 133.008214 111.9
[M+NH4]+ 152.049313 139.1
[M+K]+ 172.978648 125.5
[M+H-H2O]+ 117.012750 109.4
[M+HCOO]- 179.013691 134.1
[M+CH3COO]- 193.029341 175.2
[M+Na-2H]- 154.990156 119.8
[M]+ 134.01494142 109.6
[M]- 134.01603858 109.6
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

patents stripe