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(2S,3aS,9bR)-2-methoxy-2-methyl-3a,4,5,9b-tetrahydrobenzo[e][1,3]benzodioxole
SpectraBase Compound ID LhjzersGYwB
InChI InChI=1S/C13H16O3/c1-13(14-2)15-11-8-7-9-5-3-4-6-10(9)12(11)16-13/h3-6,11-12H,7-8H2,1-2H3/t11-,12+,13-/m0/s1
InChIKey DPOXHONLWSVRGW-XQQFMLRXSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWVMIYRPpOg
Name (2S,3aS,9bR)-2-methoxy-2-methyl-3a,4,5,9b-tetrahydrobenzo[e][1,3]benzodioxole
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.109944372 u
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-13(14-2)15-11-8-7-9-5-3-4-6-10(9)12(11)16-13/h3-6,11-12H,7-8H2,1-2H3/t11-,12+,13-/m0/s1
InChIKey DPOXHONLWSVRGW-XQQFMLRXSA-N
Instrument Name VG Autospec
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.705
Molecular Weight 220.268 g/mol
Quality 34
SMILES [C@@]12([C@@](C3=C(CC2)C=CC=C3)(O[C@@](O1)(C)OC)[H])[H]
SPLASH splash10-0002-0900000000-b55aa8b7a99f4493ebe8
Source of Spectrum ARK-2003-41-10A (DOI: 10.3998/ark.5550190.0004.705)
Wiley ID 1899987