CID 15417

Bicyclopentyl

Structural Information

Molecular Formula

C₁₀H₁₈

SMILES

C1CCC(C1)C2CCCC2

InChI

InChI=1S/C10H18/c1-2-6-9(5-1)10-7-3-4-8-10/h9-10H,1-8H2

InChIKey

MAWOHFOSAIXURX-UHFFFAOYSA-N

Compound name

cyclopentylcyclopentane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 13660
Patents: 138.14085 Da
Monoisotopic Mass: 4.6
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]+	139.148126	134.7
[M+Na]+	161.130068	138.7
[M-H]-	137.133574	140.2
[M+NH4]+	156.174673	159.2
[M+K]+	177.104008	137.3
[M+H-H2O]+	121.138110	128.9
[M+HCOO]-	183.139051	156.0
[M+CH3COO]-	197.154701	172.2
[M+Na-2H]-	159.115516	135.8
[M]+	138.14030142	128.1
[M]-	138.14139858	128.1

Literature stripe

literature stripe

Patent stripe

patents stripe