CID 524394

3-chlorotetrahydrofuran

Structural Information

Molecular Formula

SMILES

C1COCC1Cl

InChI

InChI=1S/C4H7ClO/c5-4-1-2-6-3-4/h4H,1-3H2

InChIKey

FPHNWFFKQCPXPI-UHFFFAOYSA-N

Compound name

3-chlorooxolane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 283
Patents: 106.01854 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]+	107.02582	115.6
[M+Na]+	129.00776	127.4
[M+NH4]+	124.05236	125.8
[M+K]+	144.98170	123.1
[M-H]-	105.01126	118.7
[M+Na-2H]-	126.99321	121.2
[M]+	106.01799	118.3
[M]-	106.01909	118.3

Literature stripe

literature stripe

Patent stripe

patents stripe