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

22
Patents

165.03607 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.04335 128.9
[M+Na]+ 188.02529 141.5
[M-H]- 164.02879 132.0
[M+NH4]+ 183.06989 150.8
[M+K]+ 203.99923 137.8
[M+H-H2O]+ 148.03333 123.0
[M+HCOO]- 210.03427 149.1
[M+CH3COO]- 224.04992 143.8
[M+Na-2H]- 186.01074 134.6
[M]+ 165.03552 131.8
[M]- 165.03662 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