CID 203302

14122-48-6

Structural Information

Molecular Formula
C15H20N2S
SMILES
CC(C)N=C1N(C(=CS1)C2=CC=CC=C2)C(C)C
InChI
InChI=1S/C15H20N2S/c1-11(2)16-15-17(12(3)4)14(10-18-15)13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKey
NTGKGTCEDLMMRW-UHFFFAOYSA-N
Compound name
4-phenyl-N,3-di(propan-2-yl)-1,3-thiazol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.1347 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.14198 160.9
[M+Na]+ 283.12392 168.9
[M-H]- 259.12742 168.3
[M+NH4]+ 278.16852 179.6
[M+K]+ 299.09786 165.2
[M+H-H2O]+ 243.13196 153.3
[M+HCOO]- 305.13290 180.0
[M+CH3COO]- 319.14855 201.2
[M+Na-2H]- 281.10937 160.0
[M]+ 260.13415 164.1
[M]- 260.13525 164.1
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.