CID 25071

Methylamino matacil

Structural Information

Molecular Formula

C₁₀H₁₄N₂O₂

SMILES

CC1=C(C=CC(=C1)OC(=O)NC)NC

InChI

InChI=1S/C10H14N2O2/c1-7-6-8(14-10(13)12-3)4-5-9(7)11-2/h4-6,11H,1-3H3,(H,12,13)

InChIKey

CIMAHVATEIHIFU-UHFFFAOYSA-N

Compound name

[3-methyl-4-(methylamino)phenyl] N-methylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 194.10553 Da
Monoisotopic Mass: 1.9
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]+	195.112806	142.0
[M+Na]+	217.094748	149.2
[M-H]-	193.098254	146.2
[M+NH4]+	212.139353	161.4
[M+K]+	233.068688	148.0
[M+H-H2O]+	177.102790	135.7
[M+HCOO]-	239.103731	168.0
[M+CH3COO]-	253.119381	189.2
[M+Na-2H]-	215.080196	147.6
[M]+	194.10498142	142.9
[M]-	194.10607858	142.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.