CID 79124

Nitrosoethane

Structural Information

Molecular Formula
C2H5NO
SMILES
CCN=O
InChI
InChI=1S/C2H5NO/c1-2-3-4/h2H2,1H3
InChIKey
IFYCAQIXDKZDTB-UHFFFAOYSA-N
Compound name
nitrosoethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

19
References

16818
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 104.8
[M+Na]+ 82.026331 113.5
[M-H]- 58.029837 107.2
[M+NH4]+ 77.070936 130.2
[M+K]+ 98.000271 115.3
[M+H-H2O]+ 42.034373 100.6
[M+HCOO]- 104.03531 132.9
[M+CH3COO]- 118.05096 163.6
[M+Na-2H]- 80.011779 114.9
[M]+ 59.036564 106.4
[M]- 59.037662 106.4
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