CID 85532811

111266-25-2

Structural Information

Molecular Formula

C₉H₁₄O

SMILES

C1CC12CC3CC2CC3O

InChI

InChI=1S/C9H14O/c10-8-4-7-3-6(8)5-9(7)1-2-9/h6-8,10H,1-5H2

InChIKey

GWSLRCMNJUXYTP-UHFFFAOYSA-N

Compound name

spiro[bicyclo[2.2.1]heptane-5,1'-cyclopropane]-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 138.10446 Da
Monoisotopic Mass: 1.7
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]+	139.11174	131.6
[M+Na]+	161.09368	142.3
[M+NH4]+	156.13828	143.9
[M+K]+	177.06762	139.2
[M-H]-	137.09718	140.0
[M+Na-2H]-	159.07913	137.7
[M]+	138.10391	136.6
[M]-	138.10501	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.