CID 57795414

914780-95-3

Structural Information

Molecular Formula
C11H17NO3
SMILES
C1CC2(CCC13CC(=O)NC3)OCCO2
InChI
InChI=1S/C11H17NO3/c13-9-7-10(8-12-9)1-3-11(4-2-10)14-5-6-15-11/h1-8H2,(H,12,13)
InChIKey
NUPNYQFGLIQQGM-UHFFFAOYSA-N
Compound name
9,12-dioxa-3-azadispiro[4.2.48.25]tetradecan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

211.12085 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 148.7
[M+Na]+ 234.11007 156.5
[M+NH4]+ 229.15467 159.6
[M+K]+ 250.08401 152.1
[M-H]- 210.11357 152.7
[M+Na-2H]- 232.09552 153.2
[M]+ 211.12030 150.9
[M]- 211.12140 150.9
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

patents stripe