CID 8209

1-tetradecanol

Structural Information

Molecular Formula

C₁₄H₃₀O

SMILES

CCCCCCCCCCCCCCO

InChI

InChI=1S/C14H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-14H2,1H3

InChIKey

HLZKNKRTKFSKGZ-UHFFFAOYSA-N

Compound name

tetradecan-1-ol

Related CIDs

2D Structure

compound 2d structure

10
Annotation Hits: 103
References: 141704
Patents: 214.22966 Da
Monoisotopic Mass: 6.2
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]+	215.23694	159.1
[M+Na]+	237.21888	162.6
[M-H]-	213.22238	156.5
[M+NH4]+	232.26348	177.4
[M+K]+	253.19282	159.9
[M+H-H2O]+	197.22692	153.4
[M+HCOO]-	259.22786	179.0
[M+CH3COO]-	273.24351	190.8
[M+Na-2H]-	235.20433	161.4
[M]+	214.22911	163.0
[M]-	214.23021	163.0

Literature stripe

literature stripe

Patent stripe

patents stripe