CID 12850

714-69-2

Structural Information

Molecular Formula
C10H16N2O3
SMILES
C1CCCC2(CC1)C(=O)N(C(=O)N2)CO
InChI
InChI=1S/C10H16N2O3/c13-7-12-8(14)10(11-9(12)15)5-3-1-2-4-6-10/h13H,1-7H2,(H,11,15)
InChIKey
YLINVOUPSJUXAU-UHFFFAOYSA-N
Compound name
3-(hydroxymethyl)-1,3-diazaspiro[4.6]undecane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.11609 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.12337 145.5
[M+Na]+ 235.10531 150.0
[M-H]- 211.10881 146.6
[M+NH4]+ 230.14991 162.6
[M+K]+ 251.07925 150.1
[M+H-H2O]+ 195.11335 138.1
[M+HCOO]- 257.11429 159.5
[M+CH3COO]- 271.12994 180.7
[M+Na-2H]- 233.09076 147.2
[M]+ 212.11554 135.9
[M]- 212.11664 135.9
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.