CID 7138463

5-(4-methylpiperazin-1-yl)pentan-1-amine

Structural Information

Molecular Formula
C10H23N3
SMILES
CN1CCN(CC1)CCCCCN
InChI
InChI=1S/C10H23N3/c1-12-7-9-13(10-8-12)6-4-2-3-5-11/h2-11H2,1H3
InChIKey
XMYJIRKAMFCJSV-UHFFFAOYSA-N
Compound name
5-(4-methylpiperazin-1-yl)pentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

185.1892 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.19648 147.5
[M+Na]+ 208.17842 151.4
[M-H]- 184.18192 146.4
[M+NH4]+ 203.22302 164.1
[M+K]+ 224.15236 149.4
[M+H-H2O]+ 168.18646 139.5
[M+HCOO]- 230.18740 165.1
[M+CH3COO]- 244.20305 186.1
[M+Na-2H]- 206.16387 150.6
[M]+ 185.18865 143.1
[M]- 185.18975 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