CID 120766

2-butyl-2-methylthiazolidine

Structural Information

Molecular Formula
C8H17NS
SMILES
CCCCC1(NCCS1)C
InChI
InChI=1S/C8H17NS/c1-3-4-5-8(2)9-6-7-10-8/h9H,3-7H2,1-2H3
InChIKey
FRQZYPALTIYXIY-UHFFFAOYSA-N
Compound name
2-butyl-2-methyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

159.10817 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.11545 135.4
[M+Na]+ 182.09739 142.0
[M-H]- 158.10089 135.9
[M+NH4]+ 177.14199 158.6
[M+K]+ 198.07133 139.7
[M+H-H2O]+ 142.10543 130.5
[M+HCOO]- 204.10637 150.1
[M+CH3COO]- 218.12202 172.7
[M+Na-2H]- 180.08284 137.1
[M]+ 159.10762 134.1
[M]- 159.10872 134.1
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

patents stripe