CID 210105

Brn 0922230

Structural Information

Molecular Formula
C10H16N4O3
SMILES
CC1CC(C(=O)NN1)(CC=C)C(=O)NC(=O)N
InChI
InChI=1S/C10H16N4O3/c1-3-4-10(7(15)12-9(11)17)5-6(2)13-14-8(10)16/h3,6,13H,1,4-5H2,2H3,(H,14,16)(H3,11,12,15,17)
InChIKey
DNYLKIOAKQRLNP-UHFFFAOYSA-N
Compound name
N-carbamoyl-6-methyl-3-oxo-4-prop-2-enyldiazinane-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.12224 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.12952 155.1
[M+Na]+ 263.11146 160.0
[M-H]- 239.11496 152.4
[M+NH4]+ 258.15606 169.5
[M+K]+ 279.08540 156.8
[M+H-H2O]+ 223.11950 148.9
[M+HCOO]- 285.12044 170.2
[M+CH3COO]- 299.13609 191.0
[M+Na-2H]- 261.09691 156.2
[M]+ 240.12169 147.2
[M]- 240.12279 147.2
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.