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Dibenzo[c,e][1,2]dioxin-1(2H)-one, 3,4,4a,6a,7,8,9,10-octahydro-4a-hydroxy-3,3-dimethyl-
SpectraBase Compound ID AgIZOz7WtNK
InChI InChI=1S/C14H20O4/c1-13(2)7-10(15)12-9-5-3-4-6-11(9)17-18-14(12,16)8-13/h11,16H,3-8H2,1-2H3/t11-,14+/m0/s1
InChIKey ASVNBIRXSOHGDJ-SMDDNHRTSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36COLXLV3og
Name Dibenzo[c,e][1,2]dioxin-1(2H)-one, 3,4,4a,6a,7,8,9,10-octahydro-4a-hydroxy-3,3-dimethyl-
Alternate Name(s) (4aR,6aS)-4a-hydroxy-3,3-dimethyl-3,4,4a,6a,7,8,9,10-octahydrodibenzo[c,e][1,2]dioxin-1(2H)-one 4a-hydroxy-3,3-dimethyl-cis-3,4,4a,6a,7,8,9,10-octahydrodibenzo[c,e][1,2]dioxin-1(2H)-one
CAS Registry Number 118096-69-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-13(2)7-10(15)12-9-5-3-4-6-11(9)17-18-14(12,16)8-13/h11,16H,3-8H2,1-2H3/t11-,14+/m0/s1
InChIKey ASVNBIRXSOHGDJ-SMDDNHRTSA-N
Molecular Weight 252.310 g/mol
SMILES O[C@@]12C(C(CC(C)(C)C2)=O)=C2[C@@](OO1)(CCCC2)[H]
SPLASH splash10-00di-0090000000-6d49fc4affea1fa2da39
Source of Spectrum B-41-333-5
Wiley ID 1255569