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(1S,2S,6R,8S)-4-(methoxycarbonyl)-8-phenyl-7,9-dioxabicyclo[4.3.0]non-3-en-2-ol

View entire compound with spectra: 1 MS (GC)

(1S,2S,6R,8S)-4-(methoxycarbonyl)-8-phenyl-7,9-dioxabicyclo[4.3.0]non-3-en-2-ol
SpectraBase Compound ID CAMUDKGhUyC
InChI InChI=1S/C15H16O5/c1-18-14(17)10-7-11(16)13-12(8-10)19-15(20-13)9-5-3-2-4-6-9/h2-7,11-13,15-16H,8H2,1H3/t11-,12+,13-,15-/m0/s1
InChIKey FMNHQOCKVMRXGS-XFMPKHEZSA-N
Mol Weight 276.29 g/mol
Molecular Formula C15H16O5
Exact Mass 276.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VpRiEx0kJG
Name (1S,2S,6R,8S)-4-(methoxycarbonyl)-8-phenyl-7,9-dioxabicyclo[4.3.0]non-3-en-2-ol
Alternate Name(s) methyl (2S,3aR,7S,7aS)-7-hydroxy-2-phenyl-3a,4,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
CAS Registry Number 94903-43-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-18-14(17)10-7-11(16)13-12(8-10)19-15(20-13)9-5-3-2-4-6-9/h2-7,11-13,15-16H,8H2,1H3/t11-,12+,13-,15-/m0/s1
InChIKey FMNHQOCKVMRXGS-XFMPKHEZSA-N
Molecular Weight 276.288 g/mol
SMILES O[C@]1(C=C(C(=O)OC)C[C@@]2([C@]1(O[C@](O2)(c1ccccc1)[H])[H])[H])[H]
SPLASH splash10-00di-0900000000-2b856774c1d41427d2f6
Source of Spectrum J-50-889-8
Wiley ID 1280001