CID 5283286

14-methyl-8-hexadecen-1-ol

Structural Information

Molecular Formula

C₁₇H₃₄O

SMILES

CCC(C)CCCC/C=C/CCCCCCCO

InChI

InChI=1S/C17H34O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h5,7,17-18H,3-4,6,8-16H2,1-2H3/b7-5+

InChIKey

QRFJDYPDABYWFH-FNORWQNLSA-N

Compound name

(E)-14-methylhexadec-8-en-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 114
Patents: 254.26097 Da
Monoisotopic Mass: 6.6
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]+	255.26825	172.1
[M+Na]+	277.25019	174.5
[M-H]-	253.25369	169.1
[M+NH4]+	272.29479	188.7
[M+K]+	293.22413	170.8
[M+H-H2O]+	237.25823	166.0
[M+HCOO]-	299.25917	190.2
[M+CH3COO]-	313.27482	199.0
[M+Na-2H]-	275.23564	171.5
[M]+	254.26042	175.7
[M]-	254.26152	175.7

Literature stripe

literature stripe

Patent stripe

patents stripe