CID 350041

(4-methoxyphenyl)(phenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C14H15NO
SMILES
COC1=CC=C(C=C1)C(C2=CC=CC=C2)N
InChI
InChI=1S/C14H15NO/c1-16-13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10,14H,15H2,1H3
InChIKey
MXDBCXKVTJDKNP-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl)-phenylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

188
Patents

213.11537 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.12265 147.8
[M+Na]+ 236.10459 154.2
[M-H]- 212.10809 154.0
[M+NH4]+ 231.14919 165.7
[M+K]+ 252.07853 150.9
[M+H-H2O]+ 196.11263 140.4
[M+HCOO]- 258.11357 171.9
[M+CH3COO]- 272.12922 190.2
[M+Na-2H]- 234.09004 153.3
[M]+ 213.11482 146.4
[M]- 213.11592 146.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe