CID 70678119

(azetidin-3-yl)(phenyl)methanolhydrochloride

Structural Information

Molecular Formula
C10H13NO
SMILES
C1C(CN1)C(C2=CC=CC=C2)O
InChI
InChI=1S/C10H13NO/c12-10(9-6-11-7-9)8-4-2-1-3-5-8/h1-5,9-12H,6-7H2
InChIKey
RWCTUQGKUCSGTO-UHFFFAOYSA-N
Compound name
azetidin-3-yl(phenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

163.09972 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 134.2
[M+Na]+ 186.08894 141.4
[M+NH4]+ 181.13354 138.6
[M+K]+ 202.06288 137.6
[M-H]- 162.09244 133.7
[M+Na-2H]- 184.07439 138.8
[M]+ 163.09917 133.7
[M]- 163.10027 133.7
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.