CID 61288941

1-(2-bromoethyl)-3,5-dimethylpiperidine hydrobromide

Structural Information

Molecular Formula
C9H18BrN
SMILES
CC1CC(CN(C1)CCBr)C
InChI
InChI=1S/C9H18BrN/c1-8-5-9(2)7-11(6-8)4-3-10/h8-9H,3-7H2,1-2H3
InChIKey
KGYBIZUXMBIYSP-UHFFFAOYSA-N
Compound name
1-(2-bromoethyl)-3,5-dimethylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.06226 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.06954 144.3
[M+Na]+ 242.05148 153.9
[M-H]- 218.05498 148.6
[M+NH4]+ 237.09608 165.5
[M+K]+ 258.02542 143.4
[M+H-H2O]+ 202.05952 144.2
[M+HCOO]- 264.06046 161.0
[M+CH3COO]- 278.07611 187.6
[M+Na-2H]- 240.03693 149.2
[M]+ 219.06171 159.9
[M]- 219.06281 159.9
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.