CID 3039069

42176-24-9

Structural Information

Molecular Formula
C15H22N2O
SMILES
CCC(C1=CC=CC=C1)NC(=O)CN2CCCC2
InChI
InChI=1S/C15H22N2O/c1-2-14(13-8-4-3-5-9-13)16-15(18)12-17-10-6-7-11-17/h3-5,8-9,14H,2,6-7,10-12H2,1H3,(H,16,18)
InChIKey
SCTUPWANDJUCMC-UHFFFAOYSA-N
Compound name
N-(1-phenylpropyl)-2-pyrrolidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 160.6
[M+Na]+ 269.16244 163.4
[M-H]- 245.16594 164.7
[M+NH4]+ 264.20704 177.3
[M+K]+ 285.13638 160.7
[M+H-H2O]+ 229.17048 152.1
[M+HCOO]- 291.17142 180.7
[M+CH3COO]- 305.18707 195.3
[M+Na-2H]- 267.14789 161.6
[M]+ 246.17267 157.1
[M]- 246.17377 157.1
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.