CID 2735926

1-(3-diallylaminopropyl)piperazine

Structural Information

Molecular Formula
C13H25N3
SMILES
C=CCN(CCCN1CCNCC1)CC=C
InChI
InChI=1S/C13H25N3/c1-3-8-15(9-4-2)10-5-11-16-12-6-14-7-13-16/h3-4,14H,1-2,5-13H2
InChIKey
ZOZYCTDRMYGAKS-UHFFFAOYSA-N
Compound name
3-piperazin-1-yl-N,N-bis(prop-2-enyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.20485 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.21213 158.1
[M+Na]+ 246.19407 160.1
[M-H]- 222.19757 156.8
[M+NH4]+ 241.23867 172.8
[M+K]+ 262.16801 156.9
[M+H-H2O]+ 206.20211 149.5
[M+HCOO]- 268.20305 174.7
[M+CH3COO]- 282.21870 193.8
[M+Na-2H]- 244.17952 160.3
[M]+ 223.20430 153.4
[M]- 223.20540 153.4
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

No patent data available for this compound.