CID 18722886

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

Structural Information

Molecular Formula
C9H19N3O
SMILES
CN1CCC(CC1)NC(=O)N(C)C
InChI
InChI=1S/C9H19N3O/c1-11(2)9(13)10-8-4-6-12(3)7-5-8/h8H,4-7H2,1-3H3,(H,10,13)
InChIKey
WDMQNQCBLXTVOL-UHFFFAOYSA-N
Compound name
1,1-dimethyl-3-(1-methylpiperidin-4-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

185.15282 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.16010 144.0
[M+Na]+ 208.14204 147.9
[M-H]- 184.14554 146.9
[M+NH4]+ 203.18664 162.5
[M+K]+ 224.11598 148.3
[M+H-H2O]+ 168.15008 136.7
[M+HCOO]- 230.15102 164.9
[M+CH3COO]- 244.16667 190.1
[M+Na-2H]- 206.12749 147.2
[M]+ 185.15227 140.2
[M]- 185.15337 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