CID 24692206

2-(oxolan-2-ylmethoxy)propanoic acid

Structural Information

Molecular Formula
C8H14O4
SMILES
CC(C(=O)O)OCC1CCCO1
InChI
InChI=1S/C8H14O4/c1-6(8(9)10)12-5-7-3-2-4-11-7/h6-7H,2-5H2,1H3,(H,9,10)
InChIKey
BNCXIKWGIAISFC-UHFFFAOYSA-N
Compound name
2-(oxolan-2-ylmethoxy)propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.0892 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.09648 137.8
[M+Na]+ 197.07842 145.3
[M+NH4]+ 192.12302 144.4
[M+K]+ 213.05236 144.4
[M-H]- 173.08192 137.9
[M+Na-2H]- 195.06387 139.2
[M]+ 174.08865 138.4
[M]- 174.08975 138.4
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.