CID 54488

Amk 263

Structural Information

Molecular Formula
C20H32N2O3
SMILES
CCCCCCOCC1=CC=CC=C1NC(=O)OCCN2CCCC2
InChI
InChI=1S/C20H32N2O3/c1-2-3-4-9-15-24-17-18-10-5-6-11-19(18)21-20(23)25-16-14-22-12-7-8-13-22/h5-6,10-11H,2-4,7-9,12-17H2,1H3,(H,21,23)
InChIKey
FZFNQNKYOGPAHZ-UHFFFAOYSA-N
Compound name
2-pyrrolidin-1-ylethyl N-[2-(hexoxymethyl)phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.2413 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.24858 188.0
[M+Na]+ 371.23052 189.5
[M-H]- 347.23402 191.3
[M+NH4]+ 366.27512 200.7
[M+K]+ 387.20446 186.3
[M+H-H2O]+ 331.23856 178.3
[M+HCOO]- 393.23950 207.7
[M+CH3COO]- 407.25515 213.9
[M+Na-2H]- 369.21597 187.0
[M]+ 348.24075 190.0
[M]- 348.24185 190.0
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.