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1,4-Naphthalenedione, 5-[(acetyloxy)methyl]-4a,5,8,8a-tetrahydro-2-methoxy-4a-methyl-, (4a.alpha.,5.beta.,8a.beta.)-
SpectraBase Compound ID NeCZGfjbxv
InChI InChI=1S/C15H18O5/c1-9(16)20-8-10-5-4-6-11-14(18)12(19-3)7-13(17)15(10,11)2/h4-5,7,10-11H,6,8H2,1-3H3/t10-,11-,15+/m1/s1
InChIKey MFZSLDWSSNIIPP-HFAKWTLXSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xhZq0tD8Yz
Name 1,4-Naphthalenedione, 5-[(acetyloxy)methyl]-4a,5,8,8a-tetrahydro-2-methoxy-4a-methyl-, (4a.alpha.,5.beta.,8a.beta.)-
Alternate Name(s) 5.alpha.-acetoxymethyl-4a,5,8,8a.alpha.-tetrahydro-2-methoxy-4a.beta.-methyl-1,4-naphthalindione [(1S,4aS,8aS)-6-methoxy-8a-methyl-5,8-dioxo-1,4,4a,5,8,8a-hexahydro-1-naphthalenyl]methyl acetate
CAS Registry Number 63780-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-9(16)20-8-10-5-4-6-11-14(18)12(19-3)7-13(17)15(10,11)2/h4-5,7,10-11H,6,8H2,1-3H3/t10-,11-,15+/m1/s1
InChIKey MFZSLDWSSNIIPP-HFAKWTLXSA-N
Molecular Weight 278.304 g/mol
SMILES [C@@]12(C(C=C(C([C@]2(CC=C[C@@]1(COC(=O)C)[H])[H])=O)OC)=O)C
SPLASH splash10-014i-0090000000-a8acc43247857c3bed23
Source of Spectrum K-110-2044-0
Wiley ID 1281864