CID 1445157

1171683-48-9

Structural Information

Molecular Formula
C13H18N2O2
SMILES
COC1=CC=CC(=C1)C(=O)NC2CCNCC2
InChI
InChI=1S/C13H18N2O2/c1-17-12-4-2-3-10(9-12)13(16)15-11-5-7-14-8-6-11/h2-4,9,11,14H,5-8H2,1H3,(H,15,16)
InChIKey
RVNIFQHYLAWJDT-UHFFFAOYSA-N
Compound name
3-methoxy-N-piperidin-4-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

30
Patents

234.13683 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.144106 153.8
[M+Na]+ 257.126048 157.3
[M-H]- 233.129554 156.7
[M+NH4]+ 252.170653 168.6
[M+K]+ 273.099988 154.2
[M+H-H2O]+ 217.134090 145.6
[M+HCOO]- 279.135031 172.0
[M+CH3COO]- 293.150681 189.6
[M+Na-2H]- 255.111496 157.5
[M]+ 234.13628142 148.0
[M]- 234.13737858 148.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe