CID 21036983

1-(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine

Structural Information

Molecular Formula
C16H24N2
SMILES
C1CC1C2(CCN(CC2)CC3=CC=CC=C3)CN
InChI
InChI=1S/C16H24N2/c17-13-16(15-6-7-15)8-10-18(11-9-16)12-14-4-2-1-3-5-14/h1-5,15H,6-13,17H2
InChIKey
WISVVOCMQVKZNZ-UHFFFAOYSA-N
Compound name
(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

244.19395 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.20123 158.5
[M+Na]+ 267.18317 164.2
[M-H]- 243.18667 165.9
[M+NH4]+ 262.22777 170.8
[M+K]+ 283.15711 160.5
[M+H-H2O]+ 227.19121 150.3
[M+HCOO]- 289.19215 177.7
[M+CH3COO]- 303.20780 168.7
[M+Na-2H]- 265.16862 162.7
[M]+ 244.19340 154.9
[M]- 244.19450 154.9
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.