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1-Naphthalenecarboxylic acid, 1,4,4a,5,8,8a-hexahydro-4,4a,7-trimethyl-5,8-dioxo-, methyl ester, (1.alpha.,4.alpha.,4a.beta.,8a.alpha.)-

View entire compound with spectra: 1 MS (GC)

1-Naphthalenecarboxylic acid, 1,4,4a,5,8,8a-hexahydro-4,4a,7-trimethyl-5,8-dioxo-, methyl ester, (1.alpha.,4.alpha.,4a.beta.,8a.alpha.)-
SpectraBase Compound ID AMMhIhuifbD
InChI InChI=1S/C15H18O4/c1-8-7-11(16)15(3)9(2)5-6-10(14(18)19-4)12(15)13(8)17/h5-7,9-10,12H,1-4H3/t9-,10+,12+,15+/m0/s1
InChIKey IOGCPFWKZKAOFG-PETRGTFGSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKpzWJUGFZD
Name 1-Naphthalenecarboxylic acid, 1,4,4a,5,8,8a-hexahydro-4,4a,7-trimethyl-5,8-dioxo-, methyl ester, (1.alpha.,4.alpha.,4a.beta.,8a.alpha.)-
Alternate Name(s) 1,4,4a,5,8,8a.alpha.-hexahydro-4.alpha.,4a.beta.,7-trimethyl-5,8-dioxo-1.alpha.-naphthalincarboxylic acid-methylester Methyl (1R,4S,4aS,8aS)-4,4a,7-trimethyl-5,8-dioxo-1,4,4a,5,8,8a-hexahydro-1-naphthalenecarboxylate
CAS Registry Number 63780-15-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-8-7-11(16)15(3)9(2)5-6-10(14(18)19-4)12(15)13(8)17/h5-7,9-10,12H,1-4H3/t9-,10+,12+,15+/m0/s1
InChIKey IOGCPFWKZKAOFG-PETRGTFGSA-N
Molecular Weight 262.305 g/mol
SMILES [C@]12([C@@](C(=O)C=C(C2=O)C)([C@@](C)(C=C[C@]1(C(=O)OC)[H])[H])C)[H]
SPLASH splash10-001i-0090000000-31e7e1d426a0d8968ee7
Source of Spectrum K-110-2043-0
Wiley ID 1265818