CID 9207783

N-ethylpiperazine-1-carboxamide hydrochloride

Structural Information

Molecular Formula
C7H15N3O
SMILES
CCNC(=O)N1CCNCC1
InChI
InChI=1S/C7H15N3O/c1-2-9-7(11)10-5-3-8-4-6-10/h8H,2-6H2,1H3,(H,9,11)
InChIKey
DIDCDJTVKPODTM-UHFFFAOYSA-N
Compound name
N-ethylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

180
Patents

157.1215 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.12878 136.9
[M+Na]+ 180.11072 141.0
[M-H]- 156.11422 135.4
[M+NH4]+ 175.15532 153.8
[M+K]+ 196.08466 139.5
[M+H-H2O]+ 140.11876 129.6
[M+HCOO]- 202.11970 154.1
[M+CH3COO]- 216.13535 174.6
[M+Na-2H]- 178.09617 141.7
[M]+ 157.12095 130.1
[M]- 157.12205 130.1
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