CID 15165099

96218-78-9

Structural Information

Molecular Formula
C16H31N3O
SMILES
CC1(CN(C(=O)C(N1)(C)C)CCNC2CCCCC2)C
InChI
InChI=1S/C16H31N3O/c1-15(2)12-19(14(20)16(3,4)18-15)11-10-17-13-8-6-5-7-9-13/h13,17-18H,5-12H2,1-4H3
InChIKey
BXYLMCLXGCYKJB-UHFFFAOYSA-N
Compound name
1-[2-(cyclohexylamino)ethyl]-3,3,5,5-tetramethylpiperazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

281.2467 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.25398 171.7
[M+Na]+ 304.23592 180.3
[M+NH4]+ 299.28052 181.1
[M+K]+ 320.20986 170.3
[M-H]- 280.23942 173.9
[M+Na-2H]- 302.22137 177.6
[M]+ 281.24615 173.5
[M]- 281.24725 173.5
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

patents stripe