CID 51899

73623-10-6

Structural Information

Molecular Formula
C16H26N2O3
SMILES
CCCN(CCC)CC(COC(=O)NC1=CC=CC=C1)O
InChI
InChI=1S/C16H26N2O3/c1-3-10-18(11-4-2)12-15(19)13-21-16(20)17-14-8-6-5-7-9-14/h5-9,15,19H,3-4,10-13H2,1-2H3,(H,17,20)
InChIKey
DNSNXLIGOSCNET-UHFFFAOYSA-N
Compound name
[3-(dipropylamino)-2-hydroxypropyl] N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.19434 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.20162 173.9
[M+Na]+ 317.18356 175.9
[M-H]- 293.18706 176.2
[M+NH4]+ 312.22816 188.2
[M+K]+ 333.15750 174.8
[M+H-H2O]+ 277.19160 165.7
[M+HCOO]- 339.19254 196.0
[M+CH3COO]- 353.20819 208.8
[M+Na-2H]- 315.16901 175.1
[M]+ 294.19379 176.3
[M]- 294.19489 176.3
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.