CID 131347969

Methyl 2-amino-6-methoxybenzo[d]thiazole-4-carboxylate

Structural Information

Molecular Formula
C10H10N2O3S
SMILES
COC1=CC(=C2C(=C1)SC(=N2)N)C(=O)OC
InChI
InChI=1S/C10H10N2O3S/c1-14-5-3-6(9(13)15-2)8-7(4-5)16-10(11)12-8/h3-4H,1-2H3,(H2,11,12)
InChIKey
NOGRCFNAGABAAM-UHFFFAOYSA-N
Compound name
methyl 2-amino-6-methoxy-1,3-benzothiazole-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

238.04121 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.04849 148.4
[M+Na]+ 261.03043 159.7
[M-H]- 237.03393 152.7
[M+NH4]+ 256.07503 168.4
[M+K]+ 277.00437 156.9
[M+H-H2O]+ 221.03847 142.5
[M+HCOO]- 283.03941 168.5
[M+CH3COO]- 297.05506 191.1
[M+Na-2H]- 259.01588 151.2
[M]+ 238.04066 155.0
[M]- 238.04176 155.0
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