CID 43123241

[(3-fluorophenyl)methyl][1-(4-fluorophenyl)propyl]amine hydrochloride

Structural Information

Molecular Formula
C16H17F2N
SMILES
CCC(C1=CC=C(C=C1)F)NCC2=CC(=CC=C2)F
InChI
InChI=1S/C16H17F2N/c1-2-16(13-6-8-14(17)9-7-13)19-11-12-4-3-5-15(18)10-12/h3-10,16,19H,2,11H2,1H3
InChIKey
MQNOJJXECXOJTA-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-N-[(3-fluorophenyl)methyl]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1329 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.14018 161.7
[M+Na]+ 284.12212 174.0
[M+NH4]+ 279.16672 169.4
[M+K]+ 300.09606 165.6
[M-H]- 260.12562 164.5
[M+Na-2H]- 282.10757 169.7
[M]+ 261.13235 164.2
[M]- 261.13345 164.2
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.