CID 18446289

643083-59-4

Structural Information

Molecular Formula

C₇H₁₀O

SMILES

C#CCOCC1CC1

InChI

InChI=1S/C7H10O/c1-2-5-8-6-7-3-4-7/h1,7H,3-6H2

InChIKey

DGDGVCYDMANHKF-UHFFFAOYSA-N

Compound name

prop-2-ynoxymethylcyclopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 110.073166 Da
Monoisotopic Mass: 0.9
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]+	111.08044	117.2
[M+Na]+	133.06238	132.6
[M-H]-	109.06589	122.7
[M+NH4]+	128.10699	135.2
[M+K]+	149.03632	127.5
[M+H-H2O]+	93.070426	108.6
[M+HCOO]-	155.07137	137.7
[M+CH3COO]-	169.08702	181.9
[M+Na-2H]-	131.04783	125.8
[M]+	110.07262	117.3
[M]-	110.07371	117.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe