CID 54325624

Ethyl 6-hydrazinonicotinate

Structural Information

Molecular Formula

C₈H₁₁N₃O₂

SMILES

CCOC(=O)C1=CN=C(C=C1)NN

InChI

InChI=1S/C8H11N3O2/c1-2-13-8(12)6-3-4-7(11-9)10-5-6/h3-5H,2,9H2,1H3,(H,10,11)

InChIKey

SURXNMWQQYCEDX-UHFFFAOYSA-N

Compound name

ethyl 6-hydrazinylpyridine-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 181.08513 Da
Monoisotopic Mass: 0.6
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]+	182.09241	137.4
[M+Na]+	204.07435	144.5
[M-H]-	180.07785	139.5
[M+NH4]+	199.11895	155.2
[M+K]+	220.04829	143.1
[M+H-H2O]+	164.08239	130.2
[M+HCOO]-	226.08333	162.1
[M+CH3COO]-	240.09898	184.7
[M+Na-2H]-	202.05980	143.9
[M]+	181.08458	136.8
[M]-	181.08568	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe