CID 7138418

4-(4-ethylpiperazin-1-yl)butan-1-amine

Structural Information

Molecular Formula
C10H23N3
SMILES
CCN1CCN(CC1)CCCCN
InChI
InChI=1S/C10H23N3/c1-2-12-7-9-13(10-8-12)6-4-3-5-11/h2-11H2,1H3
InChIKey
PZNAFVVVYJUKGS-UHFFFAOYSA-N
Compound name
4-(4-ethylpiperazin-1-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

185.1892 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.196476 147.5
[M+Na]+ 208.178418 151.4
[M-H]- 184.181924 146.4
[M+NH4]+ 203.223023 164.1
[M+K]+ 224.152358 149.4
[M+H-H2O]+ 168.186460 139.5
[M+HCOO]- 230.187401 165.1
[M+CH3COO]- 244.203051 186.1
[M+Na-2H]- 206.163866 150.6
[M]+ 185.18865142 143.1
[M]- 185.18974858 143.1
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