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6-Oxo-3,4,4a,5-tetrahydro-3-hydroxy-2,2-dimethylnaphtho[1,2]pyran
SpectraBase Compound ID 5KHEhEhDcFq
InChI InChI=1S/C15H18O3/c1-15(2)13(17)8-9-7-12(16)10-5-3-4-6-11(10)14(9)18-15/h3-6,9,13-14,17H,7-8H2,1-2H3/t9-,13+,14+/m0/s1
InChIKey BXZMLPWGVQRDDD-CUOATXAZSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lwjzqx0Kkbe
Name 6-Oxo-3,4,4a,5-tetrahydro-3-hydroxy-2,2-dimethylnaphtho[1,2]pyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-15(2)13(17)8-9-7-12(16)10-5-3-4-6-11(10)14(9)18-15/h3-6,9,13-14,17H,7-8H2,1-2H3/t9-,13+,14+/m0/s1
InChIKey BXZMLPWGVQRDDD-CUOATXAZSA-N
Molecular Weight 246.306 g/mol
SMILES O[C@@]1(C[C@]2([C@@](OC1(C)C)(c1c(C(=O)C2)cccc1)[H])[H])[H]
SPLASH splash10-00kf-0900000000-f8b0fb7a0e250754e8a6
Source of Spectrum X2-49-312-1
Synonyms (3R,4aR,10bR)-3-hydroxy-2,2-dimethyl-4,4a,5,10b-tetrahydro-3H-benzo[h][1]benzopyran-6-one (3R,4aR,10bR)-2,2-dimethyl-3-oxidanyl-4,4a,5,10b-tetrahydro-3H-benzo[h]chromen-6-one
Wiley ID 1601884