CID 101407615

7-nonene-3,5-diyn-1-ol

Structural Information

Molecular Formula

C₉H₁₀O

SMILES

C/C=C/C#CC#CCCO

InChI

InChI=1S/C9H10O/c1-2-3-4-5-6-7-8-9-10/h2-3,10H,8-9H2,1H3/b3-2+

InChIKey

BPNAUFVEGQLPFM-NSCUHMNNSA-N

Compound name

(E)-non-7-en-3,5-diyn-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 134.07317 Da
Monoisotopic Mass: 1.7
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]+	135.08045	154.5
[M+Na]+	157.06239	162.4
[M+NH4]+	152.10699	154.8
[M+K]+	173.03633	152.1
[M-H]-	133.06589	142.1
[M+Na-2H]-	155.04784	152.1
[M]+	134.07262	150.7
[M]-	134.07372	150.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.