CID 3079541

126002-30-0

Structural Information

Molecular Formula
C16H26N2O
SMILES
CC(CC1=CC=C(C=C1)OCCN2CCCCC2)N
InChI
InChI=1S/C16H26N2O/c1-14(17)13-15-5-7-16(8-6-15)19-12-11-18-9-3-2-4-10-18/h5-8,14H,2-4,9-13,17H2,1H3
InChIKey
VSXMCXMPHABKPM-UHFFFAOYSA-N
Compound name
1-[4-(2-piperidin-1-ylethoxy)phenyl]propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.2045 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.21178 165.4
[M+Na]+ 285.19372 167.7
[M-H]- 261.19722 168.5
[M+NH4]+ 280.23832 179.6
[M+K]+ 301.16766 164.4
[M+H-H2O]+ 245.20176 156.4
[M+HCOO]- 307.20270 183.0
[M+CH3COO]- 321.21835 199.9
[M+Na-2H]- 283.17917 166.8
[M]+ 262.20395 160.8
[M]- 262.20505 160.8
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.