CID 56843488

3-(3-(1,3-dimethylpiperidinyl))phenol, hydrobromide

Structural Information

Molecular Formula
C13H19NO
SMILES
CN1CCCC(C1)CC2=CC(=CC=C2)O
InChI
InChI=1S/C13H19NO/c1-14-7-3-5-12(10-14)8-11-4-2-6-13(15)9-11/h2,4,6,9,12,15H,3,5,7-8,10H2,1H3
InChIKey
NEVSOIYSEJOXAL-UHFFFAOYSA-N
Compound name
3-[(1-methylpiperidin-3-yl)methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.5
[M+Na]+ 228.13589 161.5
[M+NH4]+ 223.18049 157.5
[M+K]+ 244.10983 153.9
[M-H]- 204.13939 152.4
[M+Na-2H]- 226.12134 155.9
[M]+ 205.14612 151.4
[M]- 205.14722 151.4
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.