CID 88015

2,2-dimethylthiazolidine

Structural Information

Molecular Formula
C5H11NS
SMILES
CC1(NCCS1)C
InChI
InChI=1S/C5H11NS/c1-5(2)6-3-4-7-5/h6H,3-4H2,1-2H3
InChIKey
SNPQRYOQWLOTFA-UHFFFAOYSA-N
Compound name
2,2-dimethyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

14
References

1294
Patents

117.06122 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.06850 122.4
[M+Na]+ 140.05044 130.3
[M-H]- 116.05394 123.5
[M+NH4]+ 135.09504 147.3
[M+K]+ 156.02438 128.8
[M+H-H2O]+ 100.05848 118.1
[M+HCOO]- 162.05942 138.1
[M+CH3COO]- 176.07507 163.7
[M+Na-2H]- 138.03589 125.6
[M]+ 117.06067 120.0
[M]- 117.06177 120.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe