CID 5324279

Acetaldoxime

Structural Information

Molecular Formula
C2H5NO
SMILES
C/C=N/O
InChI
InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2+
InChIKey
FZENGILVLUJGJX-NSCUHMNNSA-N
Compound name
(NE)-N-ethylidenehydroxylamine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

77
References

13564
Patents

59.037113 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 60.044389 106.0
[M+Na]+ 82.026331 114.4
[M-H]- 58.029837 107.0
[M+NH4]+ 77.070936 130.8
[M+K]+ 98.000271 115.1
[M+H-H2O]+ 42.034373 102.1
[M+HCOO]- 104.03531 132.6
[M+CH3COO]- 118.05096 160.1
[M+Na-2H]- 80.011779 115.5
[M]+ 59.036564 105.6
[M]- 59.037662 105.6
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