CID 97034714

(4-chlorofuran-2-yl)methanol

Structural Information

Molecular Formula
C5H5ClO2
SMILES
C1=C(OC=C1Cl)CO
InChI
InChI=1S/C5H5ClO2/c6-4-1-5(2-7)8-3-4/h1,3,7H,2H2
InChIKey
UGECSURURFTXGG-UHFFFAOYSA-N
Compound name
(4-chlorofuran-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

131.9978 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.00508 120.7
[M+Na]+ 154.98702 131.0
[M-H]- 130.99052 124.1
[M+NH4]+ 150.03162 143.6
[M+K]+ 170.96096 129.2
[M+H-H2O]+ 114.99506 117.3
[M+HCOO]- 176.99600 140.6
[M+CH3COO]- 191.01165 165.6
[M+Na-2H]- 152.97247 128.1
[M]+ 131.99725 123.6
[M]- 131.99835 123.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.