CID 88387

20166-73-8

Structural Information

Molecular Formula

C₁₀H₁₉NO₂

SMILES

CC(C)(CN(C)C)COC(=O)C=C

InChI

InChI=1S/C10H19NO2/c1-6-9(12)13-8-10(2,3)7-11(4)5/h6H,1,7-8H2,2-5H3

InChIKey

SZWMBBRKRKJARM-UHFFFAOYSA-N

Compound name

[3-(dimethylamino)-2,2-dimethylpropyl] prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 402
Patents: 185.14159 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]+	186.14887	143.7
[M+Na]+	208.13081	149.6
[M-H]-	184.13431	145.3
[M+NH4]+	203.17541	164.2
[M+K]+	224.10475	150.3
[M+H-H2O]+	168.13885	138.8
[M+HCOO]-	230.13979	166.2
[M+CH3COO]-	244.15544	190.2
[M+Na-2H]-	206.11626	147.8
[M]+	185.14104	147.4
[M]-	185.14214	147.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe