CID 24845409

102132-40-1

Structural Information

Molecular Formula
C26H37N3O2
SMILES
CC1(CC(C(N1)(C)C)C(=O)NCCCNCC2=CC=CC=C2OCC3=CC=CC=C3)C
InChI
InChI=1S/C26H37N3O2/c1-25(2)17-22(26(3,4)29-25)24(30)28-16-10-15-27-18-21-13-8-9-14-23(21)31-19-20-11-6-5-7-12-20/h5-9,11-14,22,27,29H,10,15-19H2,1-4H3,(H,28,30)
InChIKey
RZOXANXIDDFXSS-UHFFFAOYSA-N
Compound name
2,2,5,5-tetramethyl-N-[3-[(2-phenylmethoxyphenyl)methylamino]propyl]pyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

423.28857 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 424.29585 204.7
[M+Na]+ 446.27779 207.7
[M-H]- 422.28129 210.8
[M+NH4]+ 441.32239 217.6
[M+K]+ 462.25173 202.0
[M+H-H2O]+ 406.28583 195.4
[M+HCOO]- 468.28677 223.3
[M+CH3COO]- 482.30242 230.4
[M+Na-2H]- 444.26324 204.5
[M]+ 423.28802 204.0
[M]- 423.28912 204.0
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.