CID 3049445

64704-45-6

Structural Information

Molecular Formula
C11H22N4O2
SMILES
CCCC(C)C1(C(=O)NC(NC1=O)NN)CC
InChI
InChI=1S/C11H22N4O2/c1-4-6-7(3)11(5-2)8(16)13-10(15-12)14-9(11)17/h7,10,15H,4-6,12H2,1-3H3,(H,13,16)(H,14,17)
InChIKey
KBBOBJTXLGJSQT-UHFFFAOYSA-N
Compound name
5-ethyl-2-hydrazinyl-5-pentan-2-yl-1,3-diazinane-4,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.17427 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.18155 158.4
[M+Na]+ 265.16349 163.4
[M-H]- 241.16699 155.7
[M+NH4]+ 260.20809 173.3
[M+K]+ 281.13743 160.1
[M+H-H2O]+ 225.17153 152.2
[M+HCOO]- 287.17247 173.6
[M+CH3COO]- 301.18812 195.0
[M+Na-2H]- 263.14894 159.4
[M]+ 242.17372 152.0
[M]- 242.17482 152.0
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.