CID 135510215

N-ethyl-n'-nitro-n-nitrosoguanidine

Structural Information

Molecular Formula
C3H7N5O3
SMILES
CCN(C(=N)N[N+](=O)[O-])N=O
InChI
InChI=1S/C3H7N5O3/c1-2-7(6-9)3(4)5-8(10)11/h2H2,1H3,(H2,4,5)
InChIKey
ZGONASGBWOJHDD-UHFFFAOYSA-N
Compound name
1-ethyl-3-nitro-1-nitrosoguanidine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

121
References

58
Patents

161.05489 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.06217 129.7
[M+Na]+ 184.04411 136.3
[M+NH4]+ 179.08871 135.5
[M+K]+ 200.01805 136.6
[M-H]- 160.04761 131.2
[M+Na-2H]- 182.02956 132.8
[M]+ 161.05434 130.2
[M]- 161.05544 130.2
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