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2-[5-(2-Hydroxypropyl)oxolan-2-yl]propanoic acid
SpectraBase Compound ID 3KWjjHGTu5v
InChI InChI=1S/C10H18O4/c1-6(11)5-8-3-4-9(14-8)7(2)10(12)13/h6-9,11H,3-5H2,1-2H3,(H,12,13)
InChIKey IVOODSRSVJPWLY-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C10H18O4
Exact Mass 202.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 23KxV8uruDh
Name 2-[5-(2-Hydroxypropyl)oxolan-2-yl]propanoic acid
Comments Computed using HOSE algorithm
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Exact Mass 202.120509056 u
Formula C10H18O4
InChI InChI=1S/C10H18O4/c1-6(11)5-8-3-4-9(14-8)7(2)10(12)13/h6-9,11H,3-5H2,1-2H3,(H,12,13)
InChIKey IVOODSRSVJPWLY-UHFFFAOYSA-N
Molecular Weight 202.250 g/mol
SMILES C(C1OC(CC(O)C)CC1)(C(=O)O)C