CID 56404

92367-74-3

Structural Information

Molecular Formula
C11H13NO2
SMILES
C#CCN1C(=O)CC2(C1=O)CCCC2
InChI
InChI=1S/C11H13NO2/c1-2-7-12-9(13)8-11(10(12)14)5-3-4-6-11/h1H,3-8H2
InChIKey
FAISTMNDMCILQH-UHFFFAOYSA-N
Compound name
2-prop-2-ynyl-2-azaspiro[4.4]nonane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.09464 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 142.7
[M+Na]+ 214.08386 153.7
[M-H]- 190.08736 145.4
[M+NH4]+ 209.12846 164.2
[M+K]+ 230.05780 147.5
[M+H-H2O]+ 174.09190 131.1
[M+HCOO]- 236.09284 157.9
[M+CH3COO]- 250.10849 188.5
[M+Na-2H]- 212.06931 143.5
[M]+ 191.09409 134.8
[M]- 191.09519 134.8
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.