CID 2737112

1-pentylpiperazine

Structural Information

Molecular Formula
C9H20N2
SMILES
CCCCCN1CCNCC1
InChI
InChI=1S/C9H20N2/c1-2-3-4-7-11-8-5-10-6-9-11/h10H,2-9H2,1H3
InChIKey
MJWWNBHUIIRNDZ-UHFFFAOYSA-N
Compound name
1-pentylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3744
Patents

156.16264 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.16992 139.1
[M+Na]+ 179.15186 149.3
[M+NH4]+ 174.19646 147.1
[M+K]+ 195.12580 142.4
[M-H]- 155.15536 139.7
[M+Na-2H]- 177.13731 143.5
[M]+ 156.16209 140.5
[M]- 156.16319 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe