CID 79111263

1357451-30-9

Structural Information

Molecular Formula

C₈H₁₀O₃

SMILES

CC(C)OC1=CC=C(O1)C=O

InChI

InChI=1S/C8H10O3/c1-6(2)10-8-4-3-7(5-9)11-8/h3-6H,1-2H3

InChIKey

TXNZYEWXZZOAQG-UHFFFAOYSA-N

Compound name

5-propan-2-yloxyfuran-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 154.06299 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]+	155.07027	130.2
[M+Na]+	177.05221	141.4
[M+NH4]+	172.09681	138.0
[M+K]+	193.02615	138.6
[M-H]-	153.05571	132.0
[M+Na-2H]-	175.03766	134.8
[M]+	154.06244	132.1
[M]-	154.06354	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.