CID 43248506

2,2,3,3,3-pentafluoro-1-(4-methoxyphenyl)propan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H10F5NO
SMILES
COC1=CC=C(C=C1)C(C(C(F)(F)F)(F)F)N
InChI
InChI=1S/C10H10F5NO/c1-17-7-4-2-6(3-5-7)8(16)9(11,12)10(13,14)15/h2-5,8H,16H2,1H3
InChIKey
RZJPCMLZXWWMEL-UHFFFAOYSA-N
Compound name
2,2,3,3,3-pentafluoro-1-(4-methoxyphenyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.06825 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.07553 162.0
[M+Na]+ 278.05747 167.0
[M+NH4]+ 273.10207 164.9
[M+K]+ 294.03141 163.5
[M-H]- 254.06097 156.2
[M+Na-2H]- 276.04292 163.3
[M]+ 255.06770 160.6
[M]- 255.06880 160.6
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.