CID 50775

69781-38-0

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CC(CNC1CCCC1)OC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H22N2O2/c1-11(10-17-14-4-2-3-5-14)19-15(18)12-6-8-13(16)9-7-12/h6-9,11,14,17H,2-5,10,16H2,1H3
InChIKey
NBPLSBSQFQHXKU-UHFFFAOYSA-N
Compound name
1-(cyclopentylamino)propan-2-yl 4-aminobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.16812 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 164.1
[M+Na]+ 285.15734 171.7
[M+NH4]+ 280.20194 171.2
[M+K]+ 301.13128 168.3
[M-H]- 261.16084 167.4
[M+Na-2H]- 283.14279 168.7
[M]+ 262.16757 165.6
[M]- 262.16867 165.6
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.