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]+ 241.129516 155.1
[M+Na]+ 263.111458 160.0
[M-H]- 239.114964 152.4
[M+NH4]+ 258.156063 169.5
[M+K]+ 279.085398 156.8
[M+H-H2O]+ 223.119500 148.9
[M+HCOO]- 285.120441 170.2
[M+CH3COO]- 299.136091 191.0
[M+Na-2H]- 261.096906 156.2
[M]+ 240.12169142 147.2
[M]- 240.12278858 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.