CID 209997

20811-87-4

Structural Information

Molecular Formula
C25H33NO2
SMILES
CC1(CC(CC(N1C)(C)C)OC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C
InChI
InChI=1S/C25H33NO2/c1-24(2)17-21(18-25(3,4)26(24)5)28-23(27)16-22(19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-15,21-22H,16-18H2,1-5H3
InChIKey
JKYLARUULDDGFQ-UHFFFAOYSA-N
Compound name
(1,2,2,6,6-pentamethylpiperidin-4-yl) 3,3-diphenylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.25113 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.25841 195.2
[M+Na]+ 402.24035 199.7
[M-H]- 378.24385 202.6
[M+NH4]+ 397.28495 209.2
[M+K]+ 418.21429 195.7
[M+H-H2O]+ 362.24839 185.4
[M+HCOO]- 424.24933 210.2
[M+CH3COO]- 438.26498 221.2
[M+Na-2H]- 400.22580 194.7
[M]+ 379.25058 194.3
[M]- 379.25168 194.3
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.