CID 58464

101491-82-1

Structural Information

Molecular Formula
C18H30N2O3
SMILES
CCN(CC)CCOC(=O)N(CC)C(C)COC1=CC=CC=C1
InChI
InChI=1S/C18H30N2O3/c1-5-19(6-2)13-14-22-18(21)20(7-3)16(4)15-23-17-11-9-8-10-12-17/h8-12,16H,5-7,13-15H2,1-4H3
InChIKey
BRFPGESIEUCIMM-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl N-ethyl-N-(1-phenoxypropan-2-yl)carbamate
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 183.5
[M+Na]+ 345.21487 185.3
[M-H]- 321.21837 188.3
[M+NH4]+ 340.25947 198.0
[M+K]+ 361.18881 186.0
[M+H-H2O]+ 305.22291 174.6
[M+HCOO]- 367.22385 206.9
[M+CH3COO]- 381.23950 220.6
[M+Na-2H]- 343.20032 183.4
[M]+ 322.22510 189.8
[M]- 322.22620 189.8
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.