CID 53422433

1-decene, 1-ethoxy-

Structural Information

Molecular Formula

C₁₂H₂₄O

SMILES

CCCCCCCCC=COCC

InChI

InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h11-12H,3-10H2,1-2H3

InChIKey

OGHVFBHUBBKMAK-UHFFFAOYSA-N

Compound name

1-ethoxydec-1-ene

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 59
Patents: 184.18271 Da
Monoisotopic Mass: 5.1
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]+	185.18999	147.9
[M+Na]+	207.17193	153.1
[M-H]-	183.17543	147.2
[M+NH4]+	202.21653	168.2
[M+K]+	223.14587	151.3
[M+H-H2O]+	167.17997	142.6
[M+HCOO]-	229.18091	170.3
[M+CH3COO]-	243.19656	185.9
[M+Na-2H]-	205.15738	151.9
[M]+	184.18216	152.3
[M]-	184.18326	152.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe