CID 115013023

4-(azetidin-3-yloxy)phenol

Structural Information

Molecular Formula
C9H11NO2
SMILES
C1C(CN1)OC2=CC=C(C=C2)O
InChI
InChI=1S/C9H11NO2/c11-7-1-3-8(4-2-7)12-9-5-10-6-9/h1-4,9-11H,5-6H2
InChIKey
TYEPNGBADSLTQP-UHFFFAOYSA-N
Compound name
4-(azetidin-3-yloxy)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.07898 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.08626 130.7
[M+Na]+ 188.06820 136.5
[M-H]- 164.07170 133.2
[M+NH4]+ 183.11280 142.1
[M+K]+ 204.04214 136.9
[M+H-H2O]+ 148.07624 119.0
[M+HCOO]- 210.07718 149.7
[M+CH3COO]- 224.09283 175.7
[M+Na-2H]- 186.05365 137.0
[M]+ 165.07843 136.4
[M]- 165.07953 136.4
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.