CID 5283265

14-methyl-1-pentadecanol

Structural Information

Molecular Formula

C₁₆H₃₄O

SMILES

CC(C)CCCCCCCCCCCCCO

InChI

InChI=1S/C16H34O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h16-17H,3-15H2,1-2H3

InChIKey

CFSSWEQYBLCBLH-UHFFFAOYSA-N

Compound name

14-methylpentadecan-1-ol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 5419
Patents: 242.26097 Da
Monoisotopic Mass: 7.0
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]+	243.268246	169.1
[M+Na]+	265.250188	171.5
[M-H]-	241.253694	166.1
[M+NH4]+	260.294793	186.2
[M+K]+	281.224128	168.6
[M+H-H2O]+	225.258230	163.0
[M+HCOO]-	287.259171	187.3
[M+CH3COO]-	301.274821	197.5
[M+Na-2H]-	263.235636	168.9
[M]+	242.26042142	173.0
[M]-	242.26151858	173.0

Literature stripe

literature stripe

Patent stripe

patents stripe