CID 3047908

63868-76-8

Structural Information

Molecular Formula

C₉H₁₀N₄

SMILES

CC1=NN=C(C2=CC=CC=C12)NN

InChI

InChI=1S/C9H10N4/c1-6-7-4-2-3-5-8(7)9(11-10)13-12-6/h2-5H,10H2,1H3,(H,11,13)

InChIKey

XAJLIPKOOUAUFK-UHFFFAOYSA-N

Compound name

(4-methylphthalazin-1-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 174.09055 Da
Monoisotopic Mass: 1.1
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]+	175.097826	135.1
[M+Na]+	197.079768	144.4
[M-H]-	173.083274	137.1
[M+NH4]+	192.124373	153.3
[M+K]+	213.053708	140.7
[M+H-H2O]+	157.087810	127.5
[M+HCOO]-	219.088751	158.5
[M+CH3COO]-	233.104401	148.2
[M+Na-2H]-	195.065216	145.2
[M]+	174.09000142	133.3
[M]-	174.09109858	133.3

Literature stripe

literature stripe

Patent stripe

patents stripe