CID 204661

16763-43-2

Structural Information

Molecular Formula
C10H13NOS
SMILES
CC1(NCCS1)C2=CC=C(C=C2)O
InChI
InChI=1S/C10H13NOS/c1-10(11-6-7-13-10)8-2-4-9(12)5-3-8/h2-5,11-12H,6-7H2,1H3
InChIKey
QZOGKKILSXZWJA-UHFFFAOYSA-N
Compound name
4-(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]+ 196.079076 141.2
[M+Na]+ 218.061018 149.0
[M-H]- 194.064524 144.2
[M+NH4]+ 213.105623 162.3
[M+K]+ 234.034958 144.8
[M+H-H2O]+ 178.069060 135.9
[M+HCOO]- 240.070001 155.8
[M+CH3COO]- 254.085651 153.4
[M+Na-2H]- 216.046466 143.5
[M]+ 195.07125142 138.3
[M]- 195.07234858 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.