CID 62342453

En300-37355871

Structural Information

Molecular Formula
C10H13BrN2O
SMILES
C1CNCCC1OC2=C(C=CC=N2)Br
InChI
InChI=1S/C10H13BrN2O/c11-9-2-1-5-13-10(9)14-8-3-6-12-7-4-8/h1-2,5,8,12H,3-4,6-7H2
InChIKey
SZFPVHIFVPFUKO-UHFFFAOYSA-N
Compound name
3-bromo-2-piperidin-4-yloxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

256.02112 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.02840 148.8
[M+Na]+ 279.01034 157.4
[M-H]- 255.01384 153.2
[M+NH4]+ 274.05494 165.7
[M+K]+ 294.98428 146.1
[M+H-H2O]+ 239.01838 147.3
[M+HCOO]- 301.01932 164.2
[M+CH3COO]- 315.03497 161.3
[M+Na-2H]- 276.99579 155.8
[M]+ 256.02057 162.2
[M]- 256.02167 162.2
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

No patent data available for this compound.