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1-Naphthalenecarboxylic acid, 4,4a,5,8-tetrahydro-7-methoxy-4,4a-dimethyl-5,8-dioxo-, methyl ester, trans-
SpectraBase Compound ID FLpECEGWDX7
InChI InChI=1S/C15H16O5/c1-8-5-6-9(14(18)20-4)12-13(17)10(19-3)7-11(16)15(8,12)2/h5-8H,1-4H3/t8-,15+/m0/s1
InChIKey BIDFFPIIXLALMI-VXJOIVPMSA-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 CGGJLGesLDC
Name 1-Naphthalenecarboxylic acid, 4,4a,5,8-tetrahydro-7-methoxy-4,4a-dimethyl-5,8-dioxo-, methyl ester, trans-
CAS Registry Number 63780-29-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-8-5-6-9(14(18)20-4)12-13(17)10(19-3)7-11(16)15(8,12)2/h5-8H,1-4H3/t8-,15+/m0/s1
InChIKey BIDFFPIIXLALMI-VXJOIVPMSA-N
Molecular Weight 276.288 g/mol
SMILES C=12[C@@](C(=O)C=C(C2=O)OC)([C@@](C)(C=CC1C(=O)OC)[H])C
SPLASH splash10-03xr-0090000000-22d7136344876282f4e3
Source of Spectrum K-110-2045-0
Synonyms 4,4a,5,8-tetrahydro-7-methoxy-4.alpha.,4a.beta.-dimethyl-5,8-dioxo-1-naphthalincarboxylic acid-methylester Methyl (4S,4aS)-7-methoxy-4,4a-dimethyl-5,8-dioxo-4,4a,5,8-tetrahydro-1-naphthalenecarboxylate
Wiley ID 1279976