CID 12652264

3-methyl-1,3,7-triazaspiro[4.5]decane-2,4-dione hydrochloride

Structural Information

Molecular Formula
C8H13N3O2
SMILES
CN1C(=O)C2(CCCNC2)NC1=O
InChI
InChI=1S/C8H13N3O2/c1-11-6(12)8(10-7(11)13)3-2-4-9-5-8/h9H,2-5H2,1H3,(H,10,13)
InChIKey
QUKRRTZZHVJTSF-UHFFFAOYSA-N
Compound name
3-methyl-1,3,9-triazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

183.10077 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.108046 141.9
[M+Na]+ 206.089988 149.1
[M-H]- 182.093494 140.6
[M+NH4]+ 201.134593 160.3
[M+K]+ 222.063928 145.6
[M+H-H2O]+ 166.098030 135.0
[M+HCOO]- 228.098971 155.6
[M+CH3COO]- 242.114621 173.5
[M+Na-2H]- 204.075436 144.6
[M]+ 183.10022142 133.7
[M]- 183.10131858 133.7
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

patents stripe