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1,4-Naphthalenedione, 5-[(acetyloxy)methyl]-4a,5-dihydro-2-methoxy-4a-methyl-, trans-
SpectraBase Compound ID 4bBt0K1OCfG
InChI InChI=1S/C15H16O5/c1-9(16)20-8-10-5-4-6-11-14(18)12(19-3)7-13(17)15(10,11)2/h4-7,10H,8H2,1-3H3/t10-,15+/m1/s1
InChIKey TWXDYCGJKLSPGX-BMIGLBTASA-N
Mol Weight 276.29 g/mol
Molecular Formula C15H16O5
Exact Mass 276.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzlPn0uLo6Q
Name 1,4-Naphthalenedione, 5-[(acetyloxy)methyl]-4a,5-dihydro-2-methoxy-4a-methyl-, trans-
CAS Registry Number 63817-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-9(16)20-8-10-5-4-6-11-14(18)12(19-3)7-13(17)15(10,11)2/h4-7,10H,8H2,1-3H3/t10-,15+/m1/s1
InChIKey TWXDYCGJKLSPGX-BMIGLBTASA-N
Molecular Weight 276.288 g/mol
SMILES C=12[C@@](C(=O)C=C(C2=O)OC)([C@@](COC(=O)C)(C=CC1)[H])C
SPLASH splash10-0udi-0090000000-e4de628c07a93eb778ec
Source of Spectrum K-110-2044-0
Synonyms 5.alpha.-acetoxymethyl-4a,5-dihydro-2-methoxy-4a.beta.-methyl-1,4-naphthalindione [(1S,8aS)-6-methoxy-8a-methyl-5,8-dioxo-1,5,8,8a-tetrahydro-1-naphthalenyl]methyl acetate
Wiley ID 1279975