CID 28003

16715-83-6

Structural Information

Molecular Formula

C₁₂H₂₃NO₂

SMILES

CC(C)N(CCOC(=O)C(=C)C)C(C)C

InChI

InChI=1S/C12H23NO2/c1-9(2)12(14)15-8-7-13(10(3)4)11(5)6/h10-11H,1,7-8H2,2-6H3

InChIKey

SVYHMICYJHWXIN-UHFFFAOYSA-N

Compound name

2-[di(propan-2-yl)amino]ethyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 17
References: 2485
Patents: 213.17288 Da
Monoisotopic Mass: 2.8
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]+	214.180156	154.3
[M+Na]+	236.162098	158.3
[M-H]-	212.165604	155.4
[M+NH4]+	231.206703	173.3
[M+K]+	252.136038	159.4
[M+H-H2O]+	196.170140	148.6
[M+HCOO]-	258.171081	174.7
[M+CH3COO]-	272.186731	198.6
[M+Na-2H]-	234.147546	152.8
[M]+	213.17233142	157.2
[M]-	213.17342858	157.2

Literature stripe

literature stripe

Patent stripe

patents stripe