CID 3058778

75606-48-3

Structural Information

Molecular Formula
C8H15NS
SMILES
CC1(NCCS1)CCC=C
InChI
InChI=1S/C8H15NS/c1-3-4-5-8(2)9-6-7-10-8/h3,9H,1,4-7H2,2H3
InChIKey
SIHPZJOASJTCEC-UHFFFAOYSA-N
Compound name
2-but-3-enyl-2-methyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.09251 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.09979 134.6
[M+Na]+ 180.08173 141.5
[M-H]- 156.08523 135.2
[M+NH4]+ 175.12633 157.9
[M+K]+ 196.05567 138.6
[M+H-H2O]+ 140.08977 129.8
[M+HCOO]- 202.09071 149.5
[M+CH3COO]- 216.10636 171.8
[M+Na-2H]- 178.06718 136.3
[M]+ 157.09196 132.6
[M]- 157.09306 132.6
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.