CID 105763

3,7-decadien-1-ol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CCC=CCCC=CCCO

InChI

InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h3-4,7-8,11H,2,5-6,9-10H2,1H3

InChIKey

NANOXXPHSWMTGR-UHFFFAOYSA-N

Compound name

deca-3,7-dien-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 154.13577 Da
Monoisotopic Mass: 2.5
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	138.1
[M+Na]+	177.12499	144.1
[M-H]-	153.12849	136.5
[M+NH4]+	172.16959	158.9
[M+K]+	193.09893	141.2
[M+H-H2O]+	137.13303	133.5
[M+HCOO]-	199.13397	159.8
[M+CH3COO]-	213.14962	175.5
[M+Na-2H]-	175.11044	142.7
[M]+	154.13522	139.0
[M]-	154.13632	139.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe