CID 61288567

1-(3-bromopropyl)-4-(propan-2-yl)piperazine dihydrobromide

Structural Information

Molecular Formula
C10H21BrN2
SMILES
CC(C)N1CCN(CC1)CCCBr
InChI
InChI=1S/C10H21BrN2/c1-10(2)13-8-6-12(7-9-13)5-3-4-11/h10H,3-9H2,1-2H3
InChIKey
RKIFQYFBXGMVPW-UHFFFAOYSA-N
Compound name
1-(3-bromopropyl)-4-propan-2-ylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.0888 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.09608 152.9
[M+Na]+ 271.07802 160.9
[M-H]- 247.08152 155.3
[M+NH4]+ 266.12262 171.3
[M+K]+ 287.05196 150.5
[M+H-H2O]+ 231.08606 151.6
[M+HCOO]- 293.08700 167.1
[M+CH3COO]- 307.10265 192.7
[M+Na-2H]- 269.06347 156.8
[M]+ 248.08825 168.5
[M]- 248.08935 168.5
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.