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(8S)-10-[(2S)-5-keto-2-methyl-2H-furan-4-yl]-8-(methoxymethoxy)capraldehyde

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(8S)-10-[(2S)-5-keto-2-methyl-2H-furan-4-yl]-8-(methoxymethoxy)capraldehyde
SpectraBase Compound ID LTeaMc6M0T1
InChI InChI=1S/C17H28O5/c1-14-12-15(17(19)22-14)9-10-16(21-13-20-2)8-6-4-3-5-7-11-18/h11-12,14,16H,3-10,13H2,1-2H3/t14-,16-/m0/s1
InChIKey MDHZQYSVQGOVKA-HOCLYGCPSA-N
Mol Weight 312.41 g/mol
Molecular Formula C17H28O5
Exact Mass 312.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49zHDWYMj16
Name (8S)-10-[(2S)-5-Keto-2-methyl-2H-furan-4-yl]-8-(methoxymethoxy)capraldehyde
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.193673997 u
Formula C17H28O5
InChI InChI=1S/C17H28O5/c1-14-12-15(17(19)22-14)9-10-16(21-13-20-2)8-6-4-3-5-7-11-18/h11-12,14,16H,3-10,13H2,1-2H3/t14-,16-/m0/s1
InChIKey MDHZQYSVQGOVKA-HOCLYGCPSA-N
Molecular Weight 312.406 g/mol
SMILES C1(C(=C[C@@](O1)(C)[H])CC[C@@](OCOC)(CCCCCCC=O)[H])=O