CID 17442

2-methylphenelzine

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CC1=CC=CC=C1CCNN

InChI

InChI=1S/C9H14N2/c1-8-4-2-3-5-9(8)6-7-11-10/h2-5,11H,6-7,10H2,1H3

InChIKey

IGHQGBMZCMOLBY-UHFFFAOYSA-N

Compound name

2-(2-methylphenyl)ethylhydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 150.11569 Da
Monoisotopic Mass: 1.8
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]+	151.12297	131.8
[M+Na]+	173.10491	138.5
[M-H]-	149.10841	135.1
[M+NH4]+	168.14951	152.5
[M+K]+	189.07885	136.1
[M+H-H2O]+	133.11295	125.8
[M+HCOO]-	195.11389	157.8
[M+CH3COO]-	209.12954	181.5
[M+Na-2H]-	171.09036	138.9
[M]+	150.11514	129.6
[M]-	150.11624	129.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe