CID 94489

38726-91-9

Structural Information

Molecular Formula
C6H10N4O2
SMILES
CCNC(=O)CNC(=O)C=[N+]=[N-]
InChI
InChI=1S/C6H10N4O2/c1-2-8-5(11)3-9-6(12)4-10-7/h4H,2-3H2,1H3,(H,8,11)(H,9,12)
InChIKey
ZCTXKFPFDFOTKL-UHFFFAOYSA-N
Compound name
2-[(2-diazoacetyl)amino]-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.08037 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.087646 134.0
[M+Na]+ 193.069588 139.0
[M-H]- 169.073094 135.6
[M+NH4]+ 188.114193 153.2
[M+K]+ 209.043528 134.2
[M+H-H2O]+ 153.077630 132.4
[M+HCOO]- 215.078571 163.0
[M+CH3COO]- 229.094221 181.1
[M+Na-2H]- 191.055036 141.8
[M]+ 170.07982142 130.4
[M]- 170.08091858 130.4
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.