CID 3057293

74008-13-2

Structural Information

Molecular Formula
C15H25N2S
SMILES
C1CCC(CC1)NC2=CSC=[N+]2C3CCCCC3
InChI
InChI=1S/C15H25N2S/c1-3-7-13(8-4-1)16-15-11-18-12-17(15)14-9-5-2-6-10-14/h11-14,16H,1-10H2/q+1
InChIKey
JRHDXLPRFWPTAN-UHFFFAOYSA-N
Compound name
N,3-dicyclohexyl-1,3-thiazol-3-ium-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.17386 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.18114 161.8
[M+Na]+ 288.16308 163.5
[M-H]- 264.16658 168.5
[M+NH4]+ 283.20768 177.9
[M+K]+ 304.13702 154.0
[M+H-H2O]+ 248.17112 156.0
[M+HCOO]- 310.17206 174.0
[M+CH3COO]- 324.18771 188.7
[M+Na-2H]- 286.14853 162.4
[M]+ 265.17331 152.3
[M]- 265.17441 152.3
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.