CID 3076156

130366-23-3

Structural Information

Molecular Formula
C9H10N4OS
SMILES
C1=CC=C2C(=C1)N(C(=N)S2)CC(=O)NN
InChI
InChI=1S/C9H10N4OS/c10-9-13(5-8(14)12-11)6-3-1-2-4-7(6)15-9/h1-4,10H,5,11H2,(H,12,14)
InChIKey
DYIGPKKSBKEOHH-UHFFFAOYSA-N
Compound name
2-(2-imino-1,3-benzothiazol-3-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.05753 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.064806 143.0
[M+Na]+ 245.046748 152.7
[M-H]- 221.050254 146.9
[M+NH4]+ 240.091353 162.6
[M+K]+ 261.020688 148.2
[M+H-H2O]+ 205.054790 136.4
[M+HCOO]- 267.055731 165.0
[M+CH3COO]- 281.071381 192.1
[M+Na-2H]- 243.032196 148.1
[M]+ 222.05698142 143.8
[M]- 222.05807858 143.8
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

No patent data available for this compound.