CID 29009612

1702823-58-2

Structural Information

Molecular Formula
C14H21N3O
SMILES
CC(=O)NC1=CC=C(C=C1)CN2CCC(CC2)N
InChI
InChI=1S/C14H21N3O/c1-11(18)16-14-4-2-12(3-5-14)10-17-8-6-13(15)7-9-17/h2-5,13H,6-10,15H2,1H3,(H,16,18)
InChIKey
AXRLGJOCQBMUAP-UHFFFAOYSA-N
Compound name
N-[4-[(4-aminopiperidin-1-yl)methyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

247.16846 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.175736 159.1
[M+Na]+ 270.157678 162.8
[M-H]- 246.161184 163.0
[M+NH4]+ 265.202283 173.9
[M+K]+ 286.131618 159.4
[M+H-H2O]+ 230.165720 150.5
[M+HCOO]- 292.166661 178.7
[M+CH3COO]- 306.182311 198.7
[M+Na-2H]- 268.143126 161.3
[M]+ 247.16791142 152.8
[M]- 247.16900858 152.8
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

patents stripe