CID 45276

63917-31-7

Structural Information

Molecular Formula

C₁₃H₂₀N₂O

SMILES

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

InChI

InChI=1S/C13H20N2O/c1-9-6-10(2)13(11(3)7-9)14-12(16)8-15(4)5/h6-7H,8H2,1-5H3,(H,14,16)

InChIKey

RWCYSGUZOPWNFJ-UHFFFAOYSA-N

Compound name

2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 220.15756 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]+	221.164836	152.1
[M+Na]+	243.146778	159.1
[M-H]-	219.150284	157.6
[M+NH4]+	238.191383	171.3
[M+K]+	259.120718	158.1
[M+H-H2O]+	203.154820	145.5
[M+HCOO]-	265.155761	177.3
[M+CH3COO]-	279.171411	201.5
[M+Na-2H]-	241.132226	154.6
[M]+	220.15701142	154.4
[M]-	220.15810858	154.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe