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(2aS,8aR,8bR)-2a-Methyl-2a,3,4,6,7,8,8a,8b-octahydro-2H-naphtho[1,8-bc]furan)]-2,6-dione
SpectraBase Compound ID 2rcIdXPnGuM
InChI InChI=1S/C12H14O3/c1-12-6-2-3-7-8(13)4-5-9(10(7)12)15-11(12)14/h3,9-10H,2,4-6H2,1H3/t9-,10+,12+/m1/s1
InChIKey RGPSWHAAHVDCJT-SCVCMEIPSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FUWr48R3Zr
Name (2aS,8aR,8bR)-2a-Methyl-2a,3,4,6,7,8,8a,8b-octahydro-2H-naphtho[1,8-bc]furan)]-2,6-dione
Alternate Name(s) (2aS,8aR,8bR)-2a-methyl-3,4,7,8,8a,8b-hexahydro-2H-naphtho[1,8-bc]furan-2,6(2aH)-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-12-6-2-3-7-8(13)4-5-9(10(7)12)15-11(12)14/h3,9-10H,2,4-6H2,1H3/t9-,10+,12+/m1/s1
InChIKey RGPSWHAAHVDCJT-SCVCMEIPSA-N
Molecular Weight 206.241 g/mol
SMILES C1([C@@]2([C@]3(C(C(=O)CC[C@]3(O1)[H])=CCC2)[H])C)=O
SPLASH splash10-03di-0940000000-0c52a084296bf40ad25f
Source of Spectrum KC-0-1273-16
Wiley ID 825005