CID 3016025

38948-27-5

Structural Information

Molecular Formula
C13H20N2O
SMILES
C1CCN(CC1)CCOC2=CC=C(C=C2)N
InChI
InChI=1S/C13H20N2O/c14-12-4-6-13(7-5-12)16-11-10-15-8-2-1-3-9-15/h4-7H,1-3,8-11,14H2
InChIKey
VTBHKDHFDNLZNG-UHFFFAOYSA-N
Compound name
4-(2-piperidin-1-ylethoxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

146
Patents

220.15756 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.16484 151.4
[M+Na]+ 243.14678 155.4
[M-H]- 219.15028 155.0
[M+NH4]+ 238.19138 167.4
[M+K]+ 259.12072 152.3
[M+H-H2O]+ 203.15482 142.9
[M+HCOO]- 265.15576 171.1
[M+CH3COO]- 279.17141 190.0
[M+Na-2H]- 241.13223 155.7
[M]+ 220.15701 146.4
[M]- 220.15811 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