CID 204660

2-(2-methyl-1,3-thiazolidin-2-yl)phenol

Structural Information

Molecular Formula
C10H13NOS
SMILES
CC1(NCCS1)C2=CC=CC=C2O
InChI
InChI=1S/C10H13NOS/c1-10(11-6-7-13-10)8-4-2-3-5-9(8)12/h2-5,11-12H,6-7H2,1H3
InChIKey
UJMADGHHOYHVSC-UHFFFAOYSA-N
Compound name
2-(2-methyl-1,3-thiazolidin-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.0718 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07908 141.2
[M+Na]+ 218.06102 149.0
[M-H]- 194.06452 144.2
[M+NH4]+ 213.10562 162.3
[M+K]+ 234.03496 144.8
[M+H-H2O]+ 178.06906 135.9
[M+HCOO]- 240.07000 155.8
[M+CH3COO]- 254.08565 153.4
[M+Na-2H]- 216.04647 143.5
[M]+ 195.07125 138.3
[M]- 195.07235 138.3
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.