CID 60151745

1263089-45-7

Structural Information

Molecular Formula
C10H10ClN3S
SMILES
CC1=C(N=CC=C1)NCC2=CN=C(S2)Cl
InChI
InChI=1S/C10H10ClN3S/c1-7-3-2-4-12-9(7)13-5-8-6-14-10(11)15-8/h2-4,6H,5H2,1H3,(H,12,13)
InChIKey
FPKKPPXMUGIKKC-UHFFFAOYSA-N
Compound name
N-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

239.0284 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.035676 148.8
[M+Na]+ 262.017618 159.5
[M-H]- 238.021124 153.8
[M+NH4]+ 257.062223 167.2
[M+K]+ 277.991558 153.9
[M+H-H2O]+ 222.025660 141.7
[M+HCOO]- 284.026601 164.0
[M+CH3COO]- 298.042251 161.9
[M+Na-2H]- 260.003066 151.6
[M]+ 239.02785142 152.6
[M]- 239.02894858 152.6
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

patents stripe