CID 56759

94431-92-2

Structural Information

Molecular Formula
C19H30N2O3
SMILES
CCCCOCCOC1=CC=CC=C1C(=O)NCCN2CCCC2
InChI
InChI=1S/C19H30N2O3/c1-2-3-14-23-15-16-24-18-9-5-4-8-17(18)19(22)20-10-13-21-11-6-7-12-21/h4-5,8-9H,2-3,6-7,10-16H2,1H3,(H,20,22)
InChIKey
RKTRSOLMSAHDEC-UHFFFAOYSA-N
Compound name
2-(2-butoxyethoxy)-N-(2-pyrrolidin-1-ylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.22565 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.232926 183.2
[M+Na]+ 357.214868 185.2
[M-H]- 333.218374 186.7
[M+NH4]+ 352.259473 196.5
[M+K]+ 373.188808 182.1
[M+H-H2O]+ 317.222910 173.7
[M+HCOO]- 379.223851 203.3
[M+CH3COO]- 393.239501 211.6
[M+Na-2H]- 355.200316 182.8
[M]+ 334.22510142 184.9
[M]- 334.22619858 184.9
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.