CID 54043995

1,3-dimethyl-1-(1-methylpiperidin-4-yl)urea

Structural Information

Molecular Formula
C9H19N3O
SMILES
CNC(=O)N(C)C1CCN(CC1)C
InChI
InChI=1S/C9H19N3O/c1-10-9(13)12(3)8-4-6-11(2)7-5-8/h8H,4-7H2,1-3H3,(H,10,13)
InChIKey
LOGWQCJWHUXAKI-UHFFFAOYSA-N
Compound name
1,3-dimethyl-1-(1-methylpiperidin-4-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

185.15282 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.160096 144.0
[M+Na]+ 208.142038 147.9
[M-H]- 184.145544 146.9
[M+NH4]+ 203.186643 162.5
[M+K]+ 224.115978 148.3
[M+H-H2O]+ 168.150080 136.7
[M+HCOO]- 230.151021 164.9
[M+CH3COO]- 244.166671 190.1
[M+Na-2H]- 206.127486 147.2
[M]+ 185.15227142 140.2
[M]- 185.15336858 140.2
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