CID 84906

81074-81-9

Structural Information

Molecular Formula

C₈H₁₃NO₂

SMILES

CN(C)CC1=CC=C(O1)CO

InChI

InChI=1S/C8H13NO2/c1-9(2)5-7-3-4-8(6-10)11-7/h3-4,10H,5-6H2,1-2H3

InChIKey

BQRQOLQFLNSWNV-UHFFFAOYSA-N

Compound name

[5-[(dimethylamino)methyl]furan-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 304
Patents: 155.09464 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]+	156.10192	132.5
[M+Na]+	178.08386	142.8
[M+NH4]+	173.12846	140.7
[M+K]+	194.05780	140.0
[M-H]-	154.08736	135.3
[M+Na-2H]-	176.06931	137.3
[M]+	155.09409	134.6
[M]-	155.09519	134.6

Literature stripe

literature stripe

Patent stripe

patents stripe