CID 50694

69780-82-1

Structural Information

Molecular Formula
C14H20N2O2
SMILES
C1CCNC(C1)CCOC(=O)C2=CC(=CC=C2)N
InChI
InChI=1S/C14H20N2O2/c15-12-5-3-4-11(10-12)14(17)18-9-7-13-6-1-2-8-16-13/h3-5,10,13,16H,1-2,6-9,15H2
InChIKey
RXQHRLNVIPQORX-UHFFFAOYSA-N
Compound name
2-piperidin-2-ylethyl 3-aminobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.15248 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.159756 158.7
[M+Na]+ 271.141698 161.8
[M-H]- 247.145204 160.9
[M+NH4]+ 266.186303 172.7
[M+K]+ 287.115638 158.1
[M+H-H2O]+ 231.149740 150.4
[M+HCOO]- 293.150681 176.0
[M+CH3COO]- 307.166331 192.1
[M+Na-2H]- 269.127146 160.9
[M]+ 248.15193142 152.3
[M]- 248.15302858 152.3
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.