CID 51893

73623-05-9

Structural Information

Molecular Formula
C18H30N2O3
SMILES
CCCCN(CCCC)CC(COC(=O)NC1=CC=CC=C1)O
InChI
InChI=1S/C18H30N2O3/c1-3-5-12-20(13-6-4-2)14-17(21)15-23-18(22)19-16-10-8-7-9-11-16/h7-11,17,21H,3-6,12-15H2,1-2H3,(H,19,22)
InChIKey
FGINMWXKCSSZAI-UHFFFAOYSA-N
Compound name
[3-(dibutylamino)-2-hydroxypropyl] N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.22565 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.23293 183.0
[M+Na]+ 345.21487 184.1
[M-H]- 321.21837 184.8
[M+NH4]+ 340.25947 196.1
[M+K]+ 361.18881 182.6
[M+H-H2O]+ 305.22291 174.3
[M+HCOO]- 367.22385 204.4
[M+CH3COO]- 381.23950 214.7
[M+Na-2H]- 343.20032 183.2
[M]+ 322.22510 186.0
[M]- 322.22620 186.0
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.