CID 88491

40119-17-3

Structural Information

Molecular Formula

C₈H₁₂N₂O₂

SMILES

COC1=C(C=C(C=C1)NN)OC

InChI

InChI=1S/C8H12N2O2/c1-11-7-4-3-6(10-9)5-8(7)12-2/h3-5,10H,9H2,1-2H3

InChIKey

SMLQYLWIEBFFKG-UHFFFAOYSA-N

Compound name

(3,4-dimethoxyphenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 94
Patents: 168.08987 Da
Monoisotopic Mass: 1.3
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]+	169.09715	133.3
[M+Na]+	191.07909	141.2
[M-H]-	167.08259	137.1
[M+NH4]+	186.12369	153.4
[M+K]+	207.05303	140.1
[M+H-H2O]+	151.08713	127.1
[M+HCOO]-	213.08807	160.0
[M+CH3COO]-	227.10372	183.8
[M+Na-2H]-	189.06454	140.1
[M]+	168.08932	133.9
[M]-	168.09042	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe