CID 3058790

75606-60-9

Structural Information

Molecular Formula
C11H21NS
SMILES
CC(=C(C)CCC1(NCCS1)C)C
InChI
InChI=1S/C11H21NS/c1-9(2)10(3)5-6-11(4)12-7-8-13-11/h12H,5-8H2,1-4H3
InChIKey
JJDZEYJKWDEOBV-UHFFFAOYSA-N
Compound name
2-(3,4-dimethylpent-3-enyl)-2-methyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.13947 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.14675 148.7
[M+Na]+ 222.12869 153.8
[M-H]- 198.13219 148.9
[M+NH4]+ 217.17329 170.2
[M+K]+ 238.10263 151.1
[M+H-H2O]+ 182.13673 143.7
[M+HCOO]- 244.13767 160.5
[M+CH3COO]- 258.15332 181.8
[M+Na-2H]- 220.11414 146.7
[M]+ 199.13892 146.5
[M]- 199.14002 146.5
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.