CID 155820471

2470436-76-9

Structural Information

Molecular Formula
C10H12BrNO2
SMILES
COC1=C(C=CC(=C1)Br)C2(CNC2)O
InChI
InChI=1S/C10H12BrNO2/c1-14-9-4-7(11)2-3-8(9)10(13)5-12-6-10/h2-4,12-13H,5-6H2,1H3
InChIKey
VPTKUYGNDCGFFQ-UHFFFAOYSA-N
Compound name
3-(4-bromo-2-methoxyphenyl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.00513 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.01241 148.7
[M+Na]+ 279.99435 148.0
[M+NH4]+ 275.03895 150.8
[M+K]+ 295.96829 148.4
[M-H]- 255.99785 146.9
[M+Na-2H]- 277.97980 151.0
[M]+ 257.00458 146.0
[M]- 257.00568 146.0
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.