CID 3076650

131964-32-4

Structural Information

Molecular Formula

C₁₀H₁₇NO₃

SMILES

CN(C)CCOCC(C1=COC=C1)O

InChI

InChI=1S/C10H17NO3/c1-11(2)4-6-14-8-10(12)9-3-5-13-7-9/h3,5,7,10,12H,4,6,8H2,1-2H3

InChIKey

NVMJJKRPIYHQIW-UHFFFAOYSA-N

Compound name

2-[2-(dimethylamino)ethoxy]-1-(furan-3-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 199.12085 Da
Monoisotopic Mass: 0.0
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]+	200.128126	146.3
[M+Na]+	222.110068	151.6
[M-H]-	198.113574	150.2
[M+NH4]+	217.154673	165.4
[M+K]+	238.084008	152.9
[M+H-H2O]+	182.118110	140.0
[M+HCOO]-	244.119051	169.9
[M+CH3COO]-	258.134701	187.0
[M+Na-2H]-	220.095516	150.3
[M]+	199.12030142	150.0
[M]-	199.12139858	150.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.