CID 60869514

4-(1,3-thiazol-2-yloxy)phenol

Structural Information

Molecular Formula
C9H7NO2S
SMILES
C1=CC(=CC=C1O)OC2=NC=CS2
InChI
InChI=1S/C9H7NO2S/c11-7-1-3-8(4-2-7)12-9-10-5-6-13-9/h1-6,11H
InChIKey
GFCXHVRYLGJATR-UHFFFAOYSA-N
Compound name
4-(1,3-thiazol-2-yloxy)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.01974 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.02702 137.1
[M+Na]+ 216.00896 146.9
[M-H]- 192.01246 142.2
[M+NH4]+ 211.05356 157.1
[M+K]+ 231.98290 143.7
[M+H-H2O]+ 176.01700 130.9
[M+HCOO]- 238.01794 156.7
[M+CH3COO]- 252.03359 151.0
[M+Na-2H]- 213.99441 140.9
[M]+ 193.01919 139.6
[M]- 193.02029 139.6
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.