CID 107327

Cyclopentadecanol

Structural Information

Molecular Formula

C₁₅H₃₀O

SMILES

C1CCCCCCCC(CCCCCC1)O

InChI

InChI=1S/C15H30O/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-15/h15-16H,1-14H2

InChIKey

FFVHXGZXDRXFLQ-UHFFFAOYSA-N

Compound name

cyclopentadecanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 473
Patents: 226.22966 Da
Monoisotopic Mass: 5.4
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]+	227.23694	157.3
[M+Na]+	249.21888	156.6
[M-H]-	225.22238	155.9
[M+NH4]+	244.26348	170.9
[M+K]+	265.19282	155.2
[M+H-H2O]+	209.22692	154.3
[M+HCOO]-	271.22786	170.1
[M+CH3COO]-	285.24351	179.1
[M+Na-2H]-	247.20433	156.7
[M]+	226.22911	142.6
[M]-	226.23021	142.6

Literature stripe

literature stripe

Patent stripe

patents stripe