CID 6350

Formaldoxime

Structural Information

Molecular Formula
CH3NO
SMILES
C=NO
InChI
InChI=1S/CH3NO/c1-2-3/h3H,1H2
InChIKey
SQDFHQJTAWCFIB-UHFFFAOYSA-N
Compound name
N-methylidenehydroxylamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

28
References

55892
Patents

45.021465 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 46.028741 101.1
[M+Na]+ 68.010683 109.8
[M-H]- 44.014189 102.3
[M+NH4]+ 63.055288 126.3
[M+K]+ 83.984623 110.8
[M+H-H2O]+ 28.018725 97.4
[M+HCOO]- 90.019666 128.0
[M+CH3COO]- 104.03532 157.7
[M+Na-2H]- 65.996131 111.2
[M]+ 45.020916 100.4
[M]- 45.022014 100.4
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