CID 11199

Ethenol

Structural Information

Molecular Formula
C2H4O
SMILES
C=CO
InChI
InChI=1S/C2H4O/c1-2-3/h2-3H,1H2
InChIKey
IMROMDMJAWUWLK-UHFFFAOYSA-N
Compound name
ethenol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

34
References

81116
Patents

44.026215 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 45.033491 102.3
[M+Na]+ 67.015433 111.1
[M-H]- 43.018939 102.0
[M+NH4]+ 62.060038 127.3
[M+K]+ 82.989373 111.0
[M+H-H2O]+ 27.023475 99.2
[M+HCOO]- 89.024416 126.3
[M+CH3COO]- 103.04007 153.4
[M+Na-2H]- 65.000881 111.2
[M]+ 44.025666 100.9
[M]- 44.026764 100.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe