CID 16226734

2-[(1,3-benzothiazol-2-yl)amino]propanehydrazide

Structural Information

Molecular Formula
C10H12N4OS
SMILES
CC(C(=O)NN)NC1=NC2=CC=CC=C2S1
InChI
InChI=1S/C10H12N4OS/c1-6(9(15)14-11)12-10-13-7-4-2-3-5-8(7)16-10/h2-6H,11H2,1H3,(H,12,13)(H,14,15)
InChIKey
WYZLLODOOQMZBX-UHFFFAOYSA-N
Compound name
2-(1,3-benzothiazol-2-ylamino)propanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

236.07318 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.08046 147.8
[M+Na]+ 259.06240 155.5
[M-H]- 235.06590 151.2
[M+NH4]+ 254.10700 166.5
[M+K]+ 275.03634 152.0
[M+H-H2O]+ 219.07044 140.8
[M+HCOO]- 281.07138 168.3
[M+CH3COO]- 295.08703 195.6
[M+Na-2H]- 257.04785 152.2
[M]+ 236.07263 148.7
[M]- 236.07373 148.7
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

No patent data available for this compound.