CID 84081264

(3-cyclopropylcyclobutyl)methanol

Structural Information

Molecular Formula

C₈H₁₄O

SMILES

C1CC1C2CC(C2)CO

InChI

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

InChIKey

VDMZWKKVXGYAMU-UHFFFAOYSA-N

Compound name

(3-cyclopropylcyclobutyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 126.10446 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]+	127.111736	121.0
[M+Na]+	149.093678	128.4
[M-H]-	125.097184	127.4
[M+NH4]+	144.138283	132.0
[M+K]+	165.067618	129.2
[M+H-H2O]+	109.101720	111.0
[M+HCOO]-	171.102661	141.9
[M+CH3COO]-	185.118311	177.5
[M+Na-2H]-	147.079126	126.9
[M]+	126.10391142	129.7
[M]-	126.10500858	129.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.