CID 157881

82919-37-7

Structural Information

Molecular Formula
C21H39NO4
SMILES
CC1(CC(CC(N1C)(C)C)OC(=O)CCCCCCCCC(=O)OC)C
InChI
InChI=1S/C21H39NO4/c1-20(2)15-17(16-21(3,4)22(20)5)26-19(24)14-12-10-8-7-9-11-13-18(23)25-6/h17H,7-16H2,1-6H3
InChIKey
OTCWVYFQGYOYJO-UHFFFAOYSA-N
Compound name
1-O-methyl 10-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4152
Patents

369.2879 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.29518 189.8
[M+Na]+ 392.27712 193.7
[M-H]- 368.28062 190.5
[M+NH4]+ 387.32172 205.3
[M+K]+ 408.25106 192.4
[M+H-H2O]+ 352.28516 184.2
[M+HCOO]- 414.28610 204.0
[M+CH3COO]- 428.30175 220.4
[M+Na-2H]- 390.26257 187.8
[M]+ 369.28735 195.4
[M]- 369.28845 195.4
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

patents stripe