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(3aS,4R,5S,7aS)-7-bromo-4,5-dimethoxy-2,2-dimethyl-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxole
SpectraBase Compound ID 4SYhCta7edk
InChI InChI=1S/C11H17BrO4/c1-11(2)15-8-6(12)5-7(13-3)9(14-4)10(8)16-11/h5,7-10H,1-4H3/t7-,8+,9+,10+/m0/s1
InChIKey SEDGBUYSNZLJIP-SGIHWFKDSA-N
Mol Weight 293.16 g/mol
Molecular Formula C11H17BrO4
Exact Mass 292.031022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IETHsSCscr
Name (3aS,4R,5S,7aS)-7-bromo-4,5-dimethoxy-2,2-dimethyl-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17BrO4
InChI InChI=1S/C11H17BrO4/c1-11(2)15-8-6(12)5-7(13-3)9(14-4)10(8)16-11/h5,7-10H,1-4H3/t7-,8+,9+,10+/m0/s1
InChIKey SEDGBUYSNZLJIP-SGIHWFKDSA-N
Literature Reference DOI 10.1021/ol403220t
Molecular Weight 293.157 g/mol
SMILES C1(C)(C)O[C@@]2(C(Br)=C[C@](OC)([C@@](OC)([C@@]2(O1)[H])[H])[H])[H]
SPLASH splash10-014i-0920000000-5dcf5a35d2e3c44fc491
Source of Spectrum A1-16-228/SMS3-9
Wiley ID 1747650