CID 120855

965-39-9

Structural Information

Molecular Formula
C15H22N2O3
SMILES
C1CCN(CC1)CC(COC(=O)NC2=CC=CC=C2)O
InChI
InChI=1S/C15H22N2O3/c18-14(11-17-9-5-2-6-10-17)12-20-15(19)16-13-7-3-1-4-8-13/h1,3-4,7-8,14,18H,2,5-6,9-12H2,(H,16,19)
InChIKey
TVDOHBAVWPQLFU-UHFFFAOYSA-N
Compound name
(2-hydroxy-3-piperidin-1-ylpropyl) N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

278.16306 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.170336 165.7
[M+Na]+ 301.152278 167.0
[M-H]- 277.155784 167.8
[M+NH4]+ 296.196883 178.2
[M+K]+ 317.126218 164.5
[M+H-H2O]+ 261.160320 156.7
[M+HCOO]- 323.161261 182.4
[M+CH3COO]- 337.176911 196.9
[M+Na-2H]- 299.137726 167.9
[M]+ 278.16251142 160.8
[M]- 278.16360858 160.8
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

No patent data available for this compound.