CID 517872

(3-methylidenecyclobutyl)methanol

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

C=C1CC(C1)CO

InChI

InChI=1S/C6H10O/c1-5-2-6(3-5)4-7/h6-7H,1-4H2

InChIKey

NCCDWBWIMWQQOM-UHFFFAOYSA-N

Compound name

(3-methylidenecyclobutyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 98.073166 Da
Monoisotopic Mass: 0.6
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]+	99.080442	118.1
[M+Na]+	121.06238	124.7
[M+NH4]+	116.10699	123.0
[M+K]+	137.03632	121.1
[M-H]-	97.065890	116.4
[M+Na-2H]-	119.04783	120.7
[M]+	98.072617	117.2
[M]-	98.073715	117.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe