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4,6-O-isopropylidene-7-C-phenyl-D-gluco-hept-2-enono-.delta.-lactone

View entire compound with spectra: 1 MS (GC)

4,6-O-isopropylidene-7-C-phenyl-D-gluco-hept-2-enono-.delta.-lactone
SpectraBase Compound ID 9OPNGJWyKVe
InChI InChI=1S/C16H18O5/c1-16(2)20-11-8-9-12(17)19-14(11)15(21-16)13(18)10-6-4-3-5-7-10/h3-9,11,13-15,18H,1-2H3/t11-,13+,14+,15+/m0/s1
InChIKey HWVZYMUOGJAGRS-ZGKBOVNRSA-N
Mol Weight 290.31 g/mol
Molecular Formula C16H18O5
Exact Mass 290.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AS2FOU1iy6y
Name 4,6-O-isopropylidene-7-C-phenyl-D-gluco-hept-2-enono-.delta.-lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O5
InChI InChI=1S/C16H18O5/c1-16(2)20-11-8-9-12(17)19-14(11)15(21-16)13(18)10-6-4-3-5-7-10/h3-9,11,13-15,18H,1-2H3/t11-,13+,14+,15+/m0/s1
InChIKey HWVZYMUOGJAGRS-ZGKBOVNRSA-N
Molecular Weight 290.315 g/mol
SMILES O[C@@]([C@@]1([C@]2([C@](C=CC(O2)=O)(OC(O1)(C)C)[H])[H])[H])(c1ccccc1)[H]
SPLASH splash10-0a4i-0900000000-b76b89a8f980ebeb13a7
Source of Spectrum J-60-3130-29
Synonyms (4R,4aR,8aS)-4-((R)-Hydroxy-phenyl-methyl)-2,2-dimethyl-4a,8a-dihydro-4H-pyrano[3,2-d][1,3]dioxin-6-one (4R,4aR,8aS)-2,2-dimethyl-4-[(R)-oxidanyl(phenyl)methyl]-4a,8a-dihydro-4H-pyrano[3,2-d][1,3]dioxin-6-one
Wiley ID 1293581