CID 131112991

1883022-66-9

Structural Information

Molecular Formula
C8H11N3OS
SMILES
CON=C1CCCC2=C1SC(=N2)N
InChI
InChI=1S/C8H11N3OS/c1-12-11-6-4-2-3-5-7(6)13-8(9)10-5/h2-4H2,1H3,(H2,9,10)
InChIKey
JINSUVKOWMQGSF-UHFFFAOYSA-N
Compound name
7-methoxyimino-5,6-dihydro-4H-1,3-benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06229 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06957 139.8
[M+Na]+ 220.05151 149.3
[M+NH4]+ 215.09611 148.9
[M+K]+ 236.02545 143.4
[M-H]- 196.05501 142.6
[M+Na-2H]- 218.03696 144.0
[M]+ 197.06174 142.1
[M]- 197.06284 142.1
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

No patent data available for this compound.