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(4R*,5R*,6S*)-6-Heptyltetrahydrofuro[3,4-b]furan-2-one
SpectraBase Compound ID HECXsSbXOb5
InChI InChI=1S/C13H22O3/c1-2-3-4-5-6-7-11-13-10(9-15-11)8-12(14)16-13/h10-11,13H,2-9H2,1H3/t10-,11+,13-/m1/s1
InChIKey MIKYCKRFWFXIQS-NTZNESFSSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ea3R9C31yqQ
Name (4R*,5R*,6S*)-6-Heptyltetrahydrofuro[3,4-b]furan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-2-3-4-5-6-7-11-13-10(9-15-11)8-12(14)16-13/h10-11,13H,2-9H2,1H3/t10-,11+,13-/m1/s1
InChIKey MIKYCKRFWFXIQS-NTZNESFSSA-N
Molecular Weight 226.316 g/mol
SMILES [C@@]12(OC(C[C@@]2(CO[C@]1(CCCCCCC)[H])[H])=O)[H]
SPLASH splash10-00dj-9200000000-860293a63714f0f5398b
Source of Spectrum QA-41-456-7
Synonyms (3aR,6S,6aR)-6-heptyltetrahydrofuro[3,4-b]furan-2(3H)-one
Wiley ID 861776