CID 3060392

Brn 6066682

Structural Information

Molecular Formula
C18H22N2O
SMILES
CN1CCC(CC1)(C2=CC=CC=C2)OC3=CC=C(C=C3)N
InChI
InChI=1S/C18H22N2O/c1-20-13-11-18(12-14-20,15-5-3-2-4-6-15)21-17-9-7-16(19)8-10-17/h2-10H,11-14,19H2,1H3
InChIKey
GNVZOTBLCYEIRW-UHFFFAOYSA-N
Compound name
4-(1-methyl-4-phenylpiperidin-4-yl)oxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

282.17322 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.18050 168.4
[M+Na]+ 305.16244 173.5
[M-H]- 281.16594 175.5
[M+NH4]+ 300.20704 183.6
[M+K]+ 321.13638 168.8
[M+H-H2O]+ 265.17048 158.6
[M+HCOO]- 327.17142 187.7
[M+CH3COO]- 341.18707 178.6
[M+Na-2H]- 303.14789 172.7
[M]+ 282.17267 163.1
[M]- 282.17377 163.1
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