CID 3060506

Brn 4436108

Structural Information

Molecular Formula
C8H9N3O2S
SMILES
C1CSC(=N1)NNC(=O)C2=CC=CO2
InChI
InChI=1S/C8H9N3O2S/c12-7(6-2-1-4-13-6)10-11-8-9-3-5-14-8/h1-2,4H,3,5H2,(H,9,11)(H,10,12)
InChIKey
PODQDHGFQPWCQC-UHFFFAOYSA-N
Compound name
N'-(4,5-dihydro-1,3-thiazol-2-yl)furan-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.04155 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.04883 143.5
[M+Na]+ 234.03077 150.7
[M-H]- 210.03427 150.3
[M+NH4]+ 229.07537 163.0
[M+K]+ 250.00471 150.0
[M+H-H2O]+ 194.03881 136.9
[M+HCOO]- 256.03975 164.6
[M+CH3COO]- 270.05540 182.9
[M+Na-2H]- 232.01622 146.4
[M]+ 211.04100 144.1
[M]- 211.04210 144.1
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.