CID 65918390

2742652-84-0

Structural Information

Molecular Formula
C9H10ClNO
SMILES
C1C(CN1)(C2=CC(=CC=C2)Cl)O
InChI
InChI=1S/C9H10ClNO/c10-8-3-1-2-7(4-8)9(12)5-11-6-9/h1-4,11-12H,5-6H2
InChIKey
ZRKGUTDJVWGJDW-UHFFFAOYSA-N
Compound name
3-(3-chlorophenyl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.04509 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.052366 132.5
[M+Na]+ 206.034308 140.5
[M-H]- 182.037814 135.3
[M+NH4]+ 201.078913 146.3
[M+K]+ 222.008248 138.3
[M+H-H2O]+ 166.042350 123.0
[M+HCOO]- 228.043291 147.1
[M+CH3COO]- 242.058941 177.0
[M+Na-2H]- 204.019756 139.6
[M]+ 183.04454142 139.1
[M]- 183.04563858 139.1
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.