CID 16227622

19283-00-2

Structural Information

Molecular Formula
C11H15N3O2
SMILES
C1CCC2(CC1)C(=O)N(C(=O)N2)CCC#N
InChI
InChI=1S/C11H15N3O2/c12-7-4-8-14-9(15)11(13-10(14)16)5-2-1-3-6-11/h1-6,8H2,(H,13,16)
InChIKey
DAHGUXRCDGBYPH-UHFFFAOYSA-N
Compound name
3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.11642 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 147.4
[M+Na]+ 244.10564 156.1
[M-H]- 220.10914 147.8
[M+NH4]+ 239.15024 164.2
[M+K]+ 260.07958 150.6
[M+H-H2O]+ 204.11368 133.9
[M+HCOO]- 266.11462 160.1
[M+CH3COO]- 280.13027 195.3
[M+Na-2H]- 242.09109 149.6
[M]+ 221.11587 137.0
[M]- 221.11697 137.0
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.