CID 12865

718-81-0

Structural Information

Molecular Formula
C12H18N2O2
SMILES
C=CCN1C(=O)C2(CCCCCC2)NC1=O
InChI
InChI=1S/C12H18N2O2/c1-2-9-14-10(15)12(13-11(14)16)7-5-3-4-6-8-12/h2H,1,3-9H2,(H,13,16)
InChIKey
CMIYRAQJNQRNGC-UHFFFAOYSA-N
Compound name
3-prop-2-enyl-1,3-diazaspiro[4.6]undecane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.13683 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.144106 149.4
[M+Na]+ 245.126048 153.8
[M-H]- 221.129554 151.4
[M+NH4]+ 240.170653 166.8
[M+K]+ 261.099988 153.1
[M+H-H2O]+ 205.134090 141.6
[M+HCOO]- 267.135031 164.2
[M+CH3COO]- 281.150681 185.9
[M+Na-2H]- 243.111496 150.4
[M]+ 222.13628142 140.1
[M]- 222.13737858 140.1
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.