CID 945

Nitroxyl

Structural Information

Molecular Formula
HNO
SMILES
N=O
InChI
InChI=1S/HNO/c1-2/h1H
InChIKey
ODUCDPQEXGNKDN-UHFFFAOYSA-N
Compound name
nitroxyl
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1189
References

380160
Patents

31.005814 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 32.013090 96.2
[M+Na]+ 53.995032 105.2
[M-H]- 29.998538 97.5
[M+NH4]+ 49.039637 121.9
[M+K]+ 69.968972 106.5
[M+H-H2O]+ 14.003074 92.7
[M+HCOO]- 76.004015 123.4
[M+CH3COO]- 90.019665 155.3
[M+Na-2H]- 51.980480 106.9
[M]+ 31.005265 95.2
[M]- 31.006363 95.2
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.