CID 16004331

1050502-90-3

Structural Information

Molecular Formula
C15H23ClN2O
SMILES
CCOC1=C(C=C(C=C1)Cl)CNCC2CCNCC2
InChI
InChI=1S/C15H23ClN2O/c1-2-19-15-4-3-14(16)9-13(15)11-18-10-12-5-7-17-8-6-12/h3-4,9,12,17-18H,2,5-8,10-11H2,1H3
InChIKey
RFWAILQBKBAFHN-UHFFFAOYSA-N
Compound name
N-[(5-chloro-2-ethoxyphenyl)methyl]-1-piperidin-4-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.1499 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.15718 166.9
[M+Na]+ 305.13912 171.2
[M-H]- 281.14262 169.3
[M+NH4]+ 300.18372 181.1
[M+K]+ 321.11306 165.3
[M+H-H2O]+ 265.14716 159.1
[M+HCOO]- 327.14810 180.4
[M+CH3COO]- 341.16375 199.0
[M+Na-2H]- 303.12457 169.4
[M]+ 282.14935 164.3
[M]- 282.15045 164.3
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.