CID 54492

Amk 333

Structural Information

Molecular Formula
C17H26N2O3
SMILES
CCCOCC1=CC(=CC=C1)NC(=O)OCCN2CCCC2
InChI
InChI=1S/C17H26N2O3/c1-2-11-21-14-15-6-5-7-16(13-15)18-17(20)22-12-10-19-8-3-4-9-19/h5-7,13H,2-4,8-12,14H2,1H3,(H,18,20)
InChIKey
GQNGPZBMOIDJJM-UHFFFAOYSA-N
Compound name
2-pyrrolidin-1-ylethyl N-[3-(propoxymethyl)phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.19434 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.20162 176.0
[M+Na]+ 329.18356 184.5
[M+NH4]+ 324.22816 182.1
[M+K]+ 345.15750 179.9
[M-H]- 305.18706 178.0
[M+Na-2H]- 327.16901 180.3
[M]+ 306.19379 177.3
[M]- 306.19489 177.3
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.