CID 3057288

Thiazolidine, 3-(5-(o-tolyloxy)pentyl)-, hydrochloride

Structural Information

Molecular Formula
C15H23NOS
SMILES
CC1=CC=C(C=C1)OCCCCCN2CCSC2
InChI
InChI=1S/C15H23NOS/c1-14-5-7-15(8-6-14)17-11-4-2-3-9-16-10-12-18-13-16/h5-8H,2-4,9-13H2,1H3
InChIKey
YLCZJXWKRWPXIX-UHFFFAOYSA-N
Compound name
3-[5-(4-methylphenoxy)pentyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.15002 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.15730 163.0
[M+Na]+ 288.13924 168.7
[M-H]- 264.14274 167.6
[M+NH4]+ 283.18384 180.7
[M+K]+ 304.11318 164.9
[M+H-H2O]+ 248.14728 155.4
[M+HCOO]- 310.14822 179.0
[M+CH3COO]- 324.16387 195.1
[M+Na-2H]- 286.12469 162.2
[M]+ 265.14947 165.2
[M]- 265.15057 165.2
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.