CID 23645310

25081-93-0

Structural Information

Molecular Formula

C₁₃H₂₀N₂O₂

SMILES

CC(C1=CC(=CC=C1)OC(=O)N(C)C)N(C)C

InChI

InChI=1S/C13H20N2O2/c1-10(14(2)3)11-7-6-8-12(9-11)17-13(16)15(4)5/h6-10H,1-5H3

InChIKey

AIHREYCBCYOMLZ-UHFFFAOYSA-N

Compound name

[3-[1-(dimethylamino)ethyl]phenyl] N,N-dimethylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 5
Patents: 236.15248 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]+	237.15976	155.8
[M+Na]+	259.14170	165.6
[M+NH4]+	254.18630	163.1
[M+K]+	275.11564	161.2
[M-H]-	235.14520	158.5
[M+Na-2H]-	257.12715	161.4
[M]+	236.15193	157.7
[M]-	236.15303	157.7

Literature stripe

literature stripe

Patent stripe

patents stripe