CID 95337

2-hexyl-1-decanol

Structural Information

Molecular Formula

C₁₆H₃₄O

SMILES

CCCCCCCCC(CCCCCC)CO

InChI

InChI=1S/C16H34O/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3

InChIKey

XULHFMYCBKQGEE-UHFFFAOYSA-N

Compound name

2-hexyldecan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 3
References: 20386
Patents: 242.26097 Da
Monoisotopic Mass: 7.0
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]+	243.26825	166.2
[M+Na]+	265.25019	174.4
[M+NH4]+	260.29479	172.9
[M+K]+	281.22413	166.6
[M-H]-	241.25369	165.2
[M+Na-2H]-	263.23564	167.3
[M]+	242.26042	166.8
[M]-	242.26152	166.8

Literature stripe

literature stripe

Patent stripe

patents stripe