CID 120110

Tetradecenol

Structural Information

Molecular Formula

C₁₄H₂₈O

SMILES

C=CCCCCCCCCCCCCO

InChI

InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2,15H,1,3-14H2

InChIKey

GXBLITCOLKGJDG-UHFFFAOYSA-N

Compound name

tetradec-13-en-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 803
Patents: 212.21402 Da
Monoisotopic Mass: 5.7
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]+	213.221296	157.5
[M+Na]+	235.203238	161.3
[M-H]-	211.206744	154.9
[M+NH4]+	230.247843	175.8
[M+K]+	251.177178	157.9
[M+H-H2O]+	195.211280	151.9
[M+HCOO]-	257.212221	177.6
[M+CH3COO]-	271.227871	189.9
[M+Na-2H]-	233.188686	159.8
[M]+	212.21347142	160.7
[M]-	212.21456858	160.7

Literature stripe

literature stripe

Patent stripe

patents stripe