CID 24688468

(4-fluorophenyl)(4-methoxyphenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C14H14FNO
SMILES
COC1=CC=C(C=C1)C(C2=CC=C(C=C2)F)N
InChI
InChI=1S/C14H14FNO/c1-17-13-8-4-11(5-9-13)14(16)10-2-6-12(15)7-3-10/h2-9,14H,16H2,1H3
InChIKey
BNMHRRISVPBHAR-UHFFFAOYSA-N
Compound name
(4-fluorophenyl)-(4-methoxyphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

231.10594 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11322 150.7
[M+Na]+ 254.09516 158.1
[M-H]- 230.09866 155.9
[M+NH4]+ 249.13976 168.1
[M+K]+ 270.06910 154.3
[M+H-H2O]+ 214.10320 142.4
[M+HCOO]- 276.10414 173.7
[M+CH3COO]- 290.11979 194.1
[M+Na-2H]- 252.08061 154.8
[M]+ 231.10539 148.6
[M]- 231.10649 148.6
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