CID 123526

10-chloro-1-decanol

Structural Information

Molecular Formula

C₁₀H₂₁ClO

SMILES

C(CCCCCCl)CCCCO

InChI

InChI=1S/C10H21ClO/c11-9-7-5-3-1-2-4-6-8-10-12/h12H,1-10H2

InChIKey

OTUSESJECXGMIV-UHFFFAOYSA-N

Compound name

10-chlorodecan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 244
Patents: 192.1281 Da
Monoisotopic Mass: 3.8
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]+	193.13538	143.9
[M+Na]+	215.11732	154.4
[M+NH4]+	210.16192	152.0
[M+K]+	231.09126	146.6
[M-H]-	191.12082	143.4
[M+Na-2H]-	213.10277	147.2
[M]+	192.12755	145.4
[M]-	192.12865	145.4

Literature stripe

literature stripe

Patent stripe

patents stripe