CID 54147

Brn 4425348

Structural Information

Molecular Formula
C9H11N3O2
SMILES
C1CC(=NC1)NNC(=O)C2=CC=CO2
InChI
InChI=1S/C9H11N3O2/c13-9(7-3-2-6-14-7)12-11-8-4-1-5-10-8/h2-3,6H,1,4-5H2,(H,10,11)(H,12,13)
InChIKey
MFGNINKCNWCJIO-UHFFFAOYSA-N
Compound name
N'-(3,4-dihydro-2H-pyrrol-5-yl)furan-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 139.9
[M+Na]+ 216.07435 145.6
[M-H]- 192.07785 146.1
[M+NH4]+ 211.11895 159.1
[M+K]+ 232.04829 145.5
[M+H-H2O]+ 176.08239 132.4
[M+HCOO]- 238.08333 165.5
[M+CH3COO]- 252.09898 182.1
[M+Na-2H]- 214.05980 145.2
[M]+ 193.08458 138.3
[M]- 193.08568 138.3
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.