CID 104486

1,1-diethoxyundecane

Structural Information

Molecular Formula

C₁₅H₃₂O₂

SMILES

CCCCCCCCCCC(OCC)OCC

InChI

InChI=1S/C15H32O2/c1-4-7-8-9-10-11-12-13-14-15(16-5-2)17-6-3/h15H,4-14H2,1-3H3

InChIKey

ZQNOIYUMSNPIGA-UHFFFAOYSA-N

Compound name

1,1-diethoxyundecane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 329
Patents: 244.24023 Da
Monoisotopic Mass: 5.9
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]+	245.24751	164.1
[M+Na]+	267.22945	172.6
[M+NH4]+	262.27405	170.8
[M+K]+	283.20339	165.4
[M-H]-	243.23295	163.2
[M+Na-2H]-	265.21490	165.7
[M]+	244.23968	164.8
[M]-	244.24078	164.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe