CID 145869365

2-cyclobutylcyclobutan-1-ol

Structural Information

Molecular Formula

C₈H₁₄O

SMILES

C1CC(C1)C2CCC2O

InChI

InChI=1S/C8H14O/c9-8-5-4-7(8)6-2-1-3-6/h6-9H,1-5H2

InChIKey

WVKAZOCZPOTQSY-UHFFFAOYSA-N

Compound name

2-cyclobutylcyclobutan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 126.10446 Da
Monoisotopic Mass: 2.0
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]+	127.11174	116.5
[M+Na]+	149.09368	120.2
[M-H]-	125.09718	121.4
[M+NH4]+	144.13828	124.7
[M+K]+	165.06762	124.7
[M+H-H2O]+	109.10172	103.0
[M+HCOO]-	171.10266	134.2
[M+CH3COO]-	185.11831	183.7
[M+Na-2H]-	147.07913	121.4
[M]+	126.10391	129.5
[M]-	126.10501	129.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe