CID 24845389

102132-39-8

Structural Information

Molecular Formula
C22H35N3O2
SMILES
CC1(CC(C(N1)(C)C)C(=O)NCCCNCC2=CC=CC=C2OCC=C)C
InChI
InChI=1S/C22H35N3O2/c1-6-14-27-19-11-8-7-10-17(19)16-23-12-9-13-24-20(26)18-15-21(2,3)25-22(18,4)5/h6-8,10-11,18,23,25H,1,9,12-16H2,2-5H3,(H,24,26)
InChIKey
BZLPQOVSYSSJPA-UHFFFAOYSA-N
Compound name
2,2,5,5-tetramethyl-N-[3-[(2-prop-2-enoxyphenyl)methylamino]propyl]pyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

373.27292 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.280196 191.4
[M+Na]+ 396.262138 195.1
[M-H]- 372.265644 194.5
[M+NH4]+ 391.306743 206.8
[M+K]+ 412.236078 190.1
[M+H-H2O]+ 356.270180 184.2
[M+HCOO]- 418.271121 210.1
[M+CH3COO]- 432.286771 222.0
[M+Na-2H]- 394.247586 191.2
[M]+ 373.27237142 191.2
[M]- 373.27346858 191.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.