CID 216872

Piperidine, 1-(2-bromoallyl)-

Structural Information

Molecular Formula
C8H14BrN
SMILES
C=C(CN1CCCCC1)Br
InChI
InChI=1S/C8H14BrN/c1-8(9)7-10-5-3-2-4-6-10/h1-7H2
InChIKey
ARTRALZMYCCNTK-UHFFFAOYSA-N
Compound name
1-(2-bromoprop-2-enyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

203.03096 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.038236 139.8
[M+Na]+ 226.020178 148.0
[M-H]- 202.023684 143.7
[M+NH4]+ 221.064783 160.9
[M+K]+ 241.994118 137.8
[M+H-H2O]+ 186.028220 139.7
[M+HCOO]- 248.029161 156.1
[M+CH3COO]- 262.044811 182.7
[M+Na-2H]- 224.005626 145.4
[M]+ 203.03041142 153.2
[M]- 203.03150858 153.2
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