CID 5200238

117702-38-2

Structural Information

Molecular Formula
C14H22N2O
SMILES
COC1=CC=C(C=C1)CN2CCC(CC2)CN
InChI
InChI=1S/C14H22N2O/c1-17-14-4-2-13(3-5-14)11-16-8-6-12(10-15)7-9-16/h2-5,12H,6-11,15H2,1H3
InChIKey
ZHJBOQLHOJOBAN-UHFFFAOYSA-N
Compound name
[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

234.17322 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.180496 156.3
[M+Na]+ 257.162438 160.8
[M-H]- 233.165944 160.1
[M+NH4]+ 252.207043 172.0
[M+K]+ 273.136378 157.4
[M+H-H2O]+ 217.170480 147.8
[M+HCOO]- 279.171421 175.6
[M+CH3COO]- 293.187071 194.2
[M+Na-2H]- 255.147886 159.3
[M]+ 234.17267142 152.0
[M]- 234.17376858 152.0
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