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]+ 261.141976 160.9
[M+Na]+ 283.123918 168.9
[M-H]- 259.127424 168.3
[M+NH4]+ 278.168523 179.6
[M+K]+ 299.097858 165.2
[M+H-H2O]+ 243.131960 153.3
[M+HCOO]- 305.132901 180.0
[M+CH3COO]- 319.148551 201.2
[M+Na-2H]- 281.109366 160.0
[M]+ 260.13415142 164.1
[M]- 260.13524858 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.