CID 198577

Diacetam 5

Structural Information

Molecular Formula
C21H42N4O
SMILES
CC1(CC(CC(N1)(C)C)NCCC(=O)NC2CC(NC(C2)(C)C)(C)C)C
InChI
InChI=1S/C21H42N4O/c1-18(2)11-15(12-19(3,4)24-18)22-10-9-17(26)23-16-13-20(5,6)25-21(7,8)14-16/h15-16,22,24-25H,9-14H2,1-8H3,(H,23,26)
InChIKey
GMBXBKNMMIWUED-UHFFFAOYSA-N
Compound name
N-(2,2,6,6-tetramethylpiperidin-4-yl)-3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

405
Patents

366.33588 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.34316 187.6
[M+Na]+ 389.32510 190.7
[M-H]- 365.32860 187.6
[M+NH4]+ 384.36970 203.7
[M+K]+ 405.29904 187.2
[M+H-H2O]+ 349.33314 182.2
[M+HCOO]- 411.33408 196.9
[M+CH3COO]- 425.34973 220.8
[M+Na-2H]- 387.31055 188.2
[M]+ 366.33533 180.5
[M]- 366.33643 180.5
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