CID 10241919

Schembl7092725

Structural Information

Molecular Formula
C9H15NO4
SMILES
CCC(CC(=O)N[C@H]1CCOC1=O)O
InChI
InChI=1S/C9H15NO4/c1-2-6(11)5-8(12)10-7-3-4-14-9(7)13/h6-7,11H,2-5H2,1H3,(H,10,12)/t6?,7-/m0/s1
InChIKey
IZXCXPQWOXJOPE-MLWJPKLSSA-N
Compound name
3-hydroxy-N-[(3S)-2-oxooxolan-3-yl]pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

201.10011 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 145.3
[M+Na]+ 224.08933 150.0
[M-H]- 200.09283 147.6
[M+NH4]+ 219.13393 163.5
[M+K]+ 240.06327 150.3
[M+H-H2O]+ 184.09737 139.7
[M+HCOO]- 246.09831 165.3
[M+CH3COO]- 260.11396 183.2
[M+Na-2H]- 222.07478 146.9
[M]+ 201.09956 144.2
[M]- 201.10066 144.2
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