CID 1112324

4h-chromeno[4,3-d][1,3]thiazol-2-amine

Structural Information

Molecular Formula
C10H8N2OS
SMILES
C1C2=C(C3=CC=CC=C3O1)N=C(S2)N
InChI
InChI=1S/C10H8N2OS/c11-10-12-9-6-3-1-2-4-7(6)13-5-8(9)14-10/h1-4H,5H2,(H2,11,12)
InChIKey
NVHFPWSBQGIUJA-UHFFFAOYSA-N
Compound name
4H-chromeno[4,3-d][1,3]thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

8
Patents

204.03574 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.04302 137.3
[M+Na]+ 227.02496 148.0
[M-H]- 203.02846 142.4
[M+NH4]+ 222.06956 158.3
[M+K]+ 242.99890 145.0
[M+H-H2O]+ 187.03300 131.9
[M+HCOO]- 249.03394 154.4
[M+CH3COO]- 263.04959 151.2
[M+Na-2H]- 225.01041 143.8
[M]+ 204.03519 138.9
[M]- 204.03629 138.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe