CID 12705072

54251-80-8

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

C1CC1C2(CC2)O

InChI

InChI=1S/C6H10O/c7-6(3-4-6)5-1-2-5/h5,7H,1-4H2

InChIKey

NCSLLWAWZBUTHC-UHFFFAOYSA-N

Compound name

1-cyclopropylcyclopropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 107
Patents: 98.073166 Da
Monoisotopic Mass: 0.7
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]+	99.080442	130.2
[M+Na]+	121.06238	138.2
[M-H]-	97.065890	136.8
[M+NH4]+	116.10699	142.7
[M+K]+	137.03632	138.6
[M+H-H2O]+	81.070426	126.0
[M+HCOO]-	143.07137	149.7
[M+CH3COO]-	157.08702	178.9
[M+Na-2H]-	119.04783	136.3
[M]+	98.072617	132.8
[M]-	98.073715	132.8

Literature stripe

literature stripe

Patent stripe

patents stripe