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1,2-Benzodioxin-5(3H)-one, 6,7,8,8a-tetrahydro-8a-hydroxy-3,3,7,7-tetramethyl-
SpectraBase Compound ID 3KH6Liw4VqQ
InChI InChI=1S/C12H18O4/c1-10(2)6-9(13)8-5-11(3,4)15-16-12(8,14)7-10/h5,14H,6-7H2,1-4H3
InChIKey MDGJTCSSGYADTB-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDaErr0ZggI
Name 1,2-Benzodioxin-5(3H)-one, 6,7,8,8a-tetrahydro-8a-hydroxy-3,3,7,7-tetramethyl-
CAS Registry Number 83814-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-10(2)6-9(13)8-5-11(3,4)15-16-12(8,14)7-10/h5,14H,6-7H2,1-4H3
InChIKey MDGJTCSSGYADTB-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES OC12C(C(CC(C)(C)C2)=O)=CC(OO1)(C)C
SPLASH splash10-002f-0900000000-ee7de457ef978799e906
Source of Spectrum B-35-1418-0
Synonyms 8a-hydroxy-3,3,7,7-tetramethyl-3,7,8,8a-tetrahydro-1,2-benzo[e]dioxin-5(6H)-one 8a-hydroxy-3,3,7,7-tetramethyl-6,7,8,8a-tetrahydro-1,2-benzodioxin-5(3H)-one
Wiley ID 1227264