CID 58015366

1379222-60-2

Structural Information

Molecular Formula
C7H7N3S
SMILES
CC1=NC2=C(C=C1)N=C(S2)N
InChI
InChI=1S/C7H7N3S/c1-4-2-3-5-6(9-4)11-7(8)10-5/h2-3H,1H3,(H2,8,10)
InChIKey
XRVMRBLTLLQGKG-UHFFFAOYSA-N
Compound name
5-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

165.03607 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.043346 128.9
[M+Na]+ 188.025288 141.5
[M-H]- 164.028794 132.0
[M+NH4]+ 183.069893 150.8
[M+K]+ 203.999228 137.8
[M+H-H2O]+ 148.033330 123.0
[M+HCOO]- 210.034271 149.1
[M+CH3COO]- 224.049921 143.8
[M+Na-2H]- 186.010736 134.6
[M]+ 165.03552142 131.8
[M]- 165.03661858 131.8
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