CID 109957

5-decyn-1-ol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CCCCC#CCCCCO

InChI

InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-4,7-10H2,1H3

InChIKey

RNTNGQCWAKHVKO-UHFFFAOYSA-N

Compound name

dec-5-yn-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 23
Patents: 154.13577 Da
Monoisotopic Mass: 2.9
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]+	155.14305	135.1
[M+Na]+	177.12499	145.1
[M+NH4]+	172.16959	139.4
[M+K]+	193.09893	135.6
[M-H]-	153.12849	126.8
[M+Na-2H]-	175.11044	135.9
[M]+	154.13522	133.2
[M]-	154.13632	133.2

Literature stripe

literature stripe

Patent stripe

patents stripe