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3,6-Anhydro-5,7-bis(O-benzyl)-2-deoxy-D-<ido>-heptano-1,4-lactone
SpectraBase Compound ID JtX4NZ1vV63
InChI InChI=1S/C21H22O5/c22-19-11-17-21(26-19)20(24-13-16-9-5-2-6-10-16)18(25-17)14-23-12-15-7-3-1-4-8-15/h1-10,17-18,20-21H,11-14H2/t17-,18-,20+,21+/m1/s1
InChIKey CWIQCHQJGZMBSB-QCFAMHMHSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhZ1AWQuRFg
Name 3,6-Anhydro-5,7-bis(O-benzyl)-2-deoxy-D--heptano-1,4-lactone
Alternate Name(s) (2R,3S,3aS,6aR)-3-benzyloxy-2-(benzyloxymethyl)-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one (2R,3S,3aS,6aR)-3-phenylmethoxy-2-(phenylmethoxymethyl)-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O5
InChI InChI=1S/C21H22O5/c22-19-11-17-21(26-19)20(24-13-16-9-5-2-6-10-16)18(25-17)14-23-12-15-7-3-1-4-8-15/h1-10,17-18,20-21H,11-14H2/t17-,18-,20+,21+/m1/s1
InChIKey CWIQCHQJGZMBSB-QCFAMHMHSA-N
Molecular Weight 354.402 g/mol
SMILES [C@]12([C@](O[C@@]([C@@]2(OCc2ccccc2)[H])(COCc2ccccc2)[H])(CC(O1)=O)[H])[H]
SPLASH splash10-03di-0090000000-7c689fd14b40181d5ef9
Source of Spectrum Y5-68-800-7
Wiley ID 1546351