CID 80492964

3-[(oxetan-3-yl)amino]phenol

Structural Information

Molecular Formula
C9H11NO2
SMILES
C1C(CO1)NC2=CC(=CC=C2)O
InChI
InChI=1S/C9H11NO2/c11-9-3-1-2-7(4-9)10-8-5-12-6-8/h1-4,8,10-11H,5-6H2
InChIKey
SUNXKNOIOQNUPL-UHFFFAOYSA-N
Compound name
3-(oxetan-3-ylamino)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.07898 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.08626 128.6
[M+Na]+ 188.06820 133.9
[M-H]- 164.07170 134.6
[M+NH4]+ 183.11280 140.4
[M+K]+ 204.04214 136.3
[M+H-H2O]+ 148.07624 117.1
[M+HCOO]- 210.07718 150.5
[M+CH3COO]- 224.09283 180.3
[M+Na-2H]- 186.05365 136.7
[M]+ 165.07843 135.6
[M]- 165.07953 135.6
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.