CID 2836717

Brn 5344944

Structural Information

Molecular Formula
C14H21NO4
SMILES
C1CCC2(CC1)C(CC(=O)O2)C(=O)N3CCOCC3
InChI
InChI=1S/C14H21NO4/c16-12-10-11(13(17)15-6-8-18-9-7-15)14(19-12)4-2-1-3-5-14/h11H,1-10H2
InChIKey
XSVOGFYKOGCGOL-UHFFFAOYSA-N
Compound name
4-(morpholine-4-carbonyl)-1-oxaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

267.14706 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.154336 162.2
[M+Na]+ 290.136278 164.7
[M-H]- 266.139784 168.9
[M+NH4]+ 285.180883 177.5
[M+K]+ 306.110218 165.2
[M+H-H2O]+ 250.144320 154.8
[M+HCOO]- 312.145261 174.1
[M+CH3COO]- 326.160911 191.7
[M+Na-2H]- 288.121726 163.2
[M]+ 267.14651142 154.8
[M]- 267.14760858 154.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.