CID 126651513

4-(2-bromoethynyl)piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C7H10BrNO
SMILES
C1CNCCC1(C#CBr)O
InChI
InChI=1S/C7H10BrNO/c8-4-1-7(10)2-5-9-6-3-7/h9-10H,2-3,5-6H2
InChIKey
ZRKWBWYLKIELQK-UHFFFAOYSA-N
Compound name
4-(2-bromoethynyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.99458 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.00186 140.3
[M+Na]+ 225.98380 142.0
[M+NH4]+ 221.02840 142.9
[M+K]+ 241.95774 138.0
[M-H]- 201.98730 132.6
[M+Na-2H]- 223.96925 140.6
[M]+ 202.99403 136.6
[M]- 202.99513 136.6
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.