CID 14974009

C11-alcohol-2-ethoxylate

Structural Information

Molecular Formula

C₁₅H₃₂O₃

SMILES

CCCCCCCCCCCOCCOCCO

InChI

InChI=1S/C15H32O3/c1-2-3-4-5-6-7-8-9-10-12-17-14-15-18-13-11-16/h16H,2-15H2,1H3

InChIKey

JHLNZBMSRRDBRC-UHFFFAOYSA-N

Compound name

2-(2-undecoxyethoxy)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 260.23514 Da
Monoisotopic Mass: 4.4
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]+	261.24242	169.3
[M+Na]+	283.22436	172.2
[M-H]-	259.22786	166.3
[M+NH4]+	278.26896	185.5
[M+K]+	299.19830	170.1
[M+H-H2O]+	243.23240	162.8
[M+HCOO]-	305.23334	189.3
[M+CH3COO]-	319.24899	197.5
[M+Na-2H]-	281.20981	171.0
[M]+	260.23459	176.4
[M]-	260.23569	176.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe