CID 135683605

6005-58-9

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

C1=CC=C(C(=C1)/C(=N/O)/N)O

InChI

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

InChIKey

DVAPQSJNIZTABV-UHFFFAOYSA-N

Compound name

N',2-dihydroxybenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 12
Patents: 152.05858 Da
Monoisotopic Mass: 1.5
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	129.0
[M+Na]+	175.04780	136.1
[M-H]-	151.05130	131.3
[M+NH4]+	170.09240	148.6
[M+K]+	191.02174	134.2
[M+H-H2O]+	135.05584	123.2
[M+HCOO]-	197.05678	153.8
[M+CH3COO]-	211.07243	176.4
[M+Na-2H]-	173.03325	135.3
[M]+	152.05803	125.6
[M]-	152.05913	125.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.