CID 116047

1-piperazinecarboxamide, n,n-diisopropyl-4-methyl-, hydrochloride

Structural Information

Molecular Formula
C12H25N3O
SMILES
CC(C)N(C(C)C)C(=O)N1CCN(CC1)C
InChI
InChI=1S/C12H25N3O/c1-10(2)15(11(3)4)12(16)14-8-6-13(5)7-9-14/h10-11H,6-9H2,1-5H3
InChIKey
BOIXTFSXFOOGEW-UHFFFAOYSA-N
Compound name
4-methyl-N,N-di(propan-2-yl)piperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

227.19977 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.20705 157.5
[M+Na]+ 250.18899 160.6
[M-H]- 226.19249 158.7
[M+NH4]+ 245.23359 173.3
[M+K]+ 266.16293 161.2
[M+H-H2O]+ 210.19703 149.6
[M+HCOO]- 272.19797 173.2
[M+CH3COO]- 286.21362 198.8
[M+Na-2H]- 248.17444 156.6
[M]+ 227.19922 155.0
[M]- 227.20032 155.0
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