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

11
Patents

227.19977 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.207046 157.5
[M+Na]+ 250.188988 160.6
[M-H]- 226.192494 158.7
[M+NH4]+ 245.233593 173.3
[M+K]+ 266.162928 161.2
[M+H-H2O]+ 210.197030 149.6
[M+HCOO]- 272.197971 173.2
[M+CH3COO]- 286.213621 198.8
[M+Na-2H]- 248.174436 156.6
[M]+ 227.19922142 155.0
[M]- 227.20031858 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