CID 4962074

2792217-16-2

Structural Information

Molecular Formula
C9H19N3O
SMILES
CCCNC(=O)CN1CCNCC1
InChI
InChI=1S/C9H19N3O/c1-2-3-11-9(13)8-12-6-4-10-5-7-12/h10H,2-8H2,1H3,(H,11,13)
InChIKey
RFHNUQVGWJTISN-UHFFFAOYSA-N
Compound name
2-piperazin-1-yl-N-propylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

185.15282 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.160096 145.4
[M+Na]+ 208.142038 148.5
[M-H]- 184.145544 143.5
[M+NH4]+ 203.186643 161.1
[M+K]+ 224.115978 146.5
[M+H-H2O]+ 168.150080 137.6
[M+HCOO]- 230.151021 161.9
[M+CH3COO]- 244.166671 181.4
[M+Na-2H]- 206.127486 149.2
[M]+ 185.15227142 139.4
[M]- 185.15336858 139.4
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