CID 10221060

147795-40-2

Structural Information

Molecular Formula
C14H23NO4
SMILES
CCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O
InChI
InChI=1S/C14H23NO4/c1-2-3-4-5-6-7-11(16)10-13(17)15-12-8-9-19-14(12)18/h12H,2-10H2,1H3,(H,15,17)/t12-/m0/s1
InChIKey
KYGIKEQVUKTKRR-LBPRGKRZSA-N
Compound name
3-oxo-N-[(3S)-2-oxooxolan-3-yl]decanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

164
Patents

269.16272 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 166.6
[M+Na]+ 292.15194 169.9
[M-H]- 268.15544 169.4
[M+NH4]+ 287.19654 182.7
[M+K]+ 308.12588 169.3
[M+H-H2O]+ 252.15998 160.0
[M+HCOO]- 314.16092 186.7
[M+CH3COO]- 328.17657 199.9
[M+Na-2H]- 290.13739 166.2
[M]+ 269.16217 168.5
[M]- 269.16327 168.5
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

patents stripe