CID 93911

57988-58-6

Structural Information

Molecular Formula
C11H14BrNO
SMILES
C1CNCCC1(C2=CC=C(C=C2)Br)O
InChI
InChI=1S/C11H14BrNO/c12-10-3-1-9(2-4-10)11(14)5-7-13-8-6-11/h1-4,13-14H,5-8H2
InChIKey
QNLXJYQUWCNYBH-UHFFFAOYSA-N
Compound name
4-(4-bromophenyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

592
Patents

255.02588 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.03316 150.3
[M+Na]+ 278.01510 159.1
[M-H]- 254.01860 155.1
[M+NH4]+ 273.05970 169.8
[M+K]+ 293.98904 147.0
[M+H-H2O]+ 238.02314 150.4
[M+HCOO]- 300.02408 165.2
[M+CH3COO]- 314.03973 162.9
[M+Na-2H]- 276.00055 157.2
[M]+ 255.02533 162.3
[M]- 255.02643 162.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe