CID 604579

99072-87-4

Structural Information

Molecular Formula

C₁₀H₁₀N₄O₂

SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN

InChI

InChI=1S/C10H10N4O2/c1-14-10(16)7-5-3-2-4-6(7)8(13-14)9(15)12-11/h2-5H,11H2,1H3,(H,12,15)

InChIKey

SECNNFONKGVTDA-UHFFFAOYSA-N

Compound name

3-methyl-4-oxophthalazine-1-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 218.08037 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]+	219.087646	145.3
[M+Na]+	241.069588	155.1
[M-H]-	217.073094	147.7
[M+NH4]+	236.114193	161.7
[M+K]+	257.043528	151.7
[M+H-H2O]+	201.077630	137.5
[M+HCOO]-	263.078571	168.0
[M+CH3COO]-	277.094221	192.9
[M+Na-2H]-	239.055036	152.8
[M]+	218.07982142	144.9
[M]-	218.08091858	144.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe