CID 5891575

Schembl5310487

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1=COC(=C1)/C=C/C(=O)NN

InChI

InChI=1S/C7H8N2O2/c8-9-7(10)4-3-6-2-1-5-11-6/h1-5H,8H2,(H,9,10)/b4-3+

InChIKey

BVGHCYUPYZZBGV-ONEGZZNKSA-N

Compound name

(E)-3-(furan-2-yl)prop-2-enehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1
Patents: 152.05858 Da
Monoisotopic Mass: 0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	153.06586	130.9
[M+Na]+	175.04780	137.6
[M-H]-	151.05130	134.8
[M+NH4]+	170.09240	151.4
[M+K]+	191.02174	137.1
[M+H-H2O]+	135.05584	124.8
[M+HCOO]-	197.05678	157.1
[M+CH3COO]-	211.07243	176.2
[M+Na-2H]-	173.03325	137.1
[M]+	152.05803	129.4
[M]-	152.05913	129.4

Literature stripe

literature stripe

Patent stripe

patents stripe