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

4
Patents

203.03096 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.03824 139.8
[M+Na]+ 226.02018 148.0
[M-H]- 202.02368 143.7
[M+NH4]+ 221.06478 160.9
[M+K]+ 241.99412 137.8
[M+H-H2O]+ 186.02822 139.7
[M+HCOO]- 248.02916 156.1
[M+CH3COO]- 262.04481 182.7
[M+Na-2H]- 224.00563 145.4
[M]+ 203.03041 153.2
[M]- 203.03151 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