CID 3038881

Thiazolidine, 3-(6-(nonylthio)hexyl)-, hydrochloride

Structural Information

Molecular Formula
C18H37NS2
SMILES
CCCCCCCCCSCCCCCCN1CCSC1
InChI
InChI=1S/C18H37NS2/c1-2-3-4-5-6-8-11-15-20-16-12-9-7-10-13-19-14-17-21-18-19/h2-18H2,1H3
InChIKey
FTZIEXCDGOMURL-UHFFFAOYSA-N
Compound name
3-(6-nonylsulfanylhexyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.23676 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.24404 182.2
[M+Na]+ 354.22598 189.0
[M+NH4]+ 349.27058 190.1
[M+K]+ 370.19992 178.0
[M-H]- 330.22948 183.5
[M+Na-2H]- 352.21143 182.7
[M]+ 331.23621 184.3
[M]- 331.23731 184.3
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.