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4.beta.-Acetoxy-4a.beta.-methyl-3,4,4a,5,6,7,8a.beta.-hexahydronaphthalene-1-(2H),7(8H)-dione
SpectraBase Compound ID QcNo4HrGhn
InChI InChI=1S/C13H18O4/c1-8(14)17-12-4-3-11(16)10-7-9(15)5-6-13(10,12)2/h10,12H,3-7H2,1-2H3/t10-,12-,13-/m0/s1
InChIKey MFMYDKKHSYMDMT-DRZSPHRISA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AJ2SV15yMF
Name 4.beta.-Acetoxy-4a.beta.-methyl-3,4,4a,5,6,7,8a.beta.-hexahydronaphthalene-1-(2H),7(8H)-dione
Alternate Name(s) (1S,4aR,8aS)-8a-methyl-4,6-dioxodecahydro-1-naphthalenyl acetate
CAS Registry Number 87262-32-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-8(14)17-12-4-3-11(16)10-7-9(15)5-6-13(10,12)2/h10,12H,3-7H2,1-2H3/t10-,12-,13-/m0/s1
InChIKey MFMYDKKHSYMDMT-DRZSPHRISA-N
Molecular Weight 238.283 g/mol
SMILES [C@]12([C@](C(=O)CC[C@@]2(OC(=O)C)[H])(CC(CC1)=O)[H])C
SPLASH splash10-002p-0900000000-ef6828ffae54c52a58f3
Source of Spectrum J-48-4385-0
Wiley ID 1240485