CID 217557

Thiazolidine, 3-(6-cyclohexylhexyl)-, hydrochloride

Structural Information

Molecular Formula
C15H29NS
SMILES
C1CCC(CC1)CCCCCCN2CCSC2
InChI
InChI=1S/C15H29NS/c1(2-7-11-16-12-13-17-14-16)4-8-15-9-5-3-6-10-15/h15H,1-14H2
InChIKey
GVXZYDLVBVCHEP-UHFFFAOYSA-N
Compound name
3-(6-cyclohexylhexyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.20207 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.20935 164.5
[M+Na]+ 278.19129 166.1
[M-H]- 254.19479 167.5
[M+NH4]+ 273.23589 182.0
[M+K]+ 294.16523 162.8
[M+H-H2O]+ 238.19933 156.6
[M+HCOO]- 300.20027 175.9
[M+CH3COO]- 314.21592 193.3
[M+Na-2H]- 276.17674 161.2
[M]+ 255.20152 160.6
[M]- 255.20262 160.6
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.