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(+/-)-(2AS,3R,8AS,8BR)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID
SpectraBase Compound ID 1vatC7y1fmW
InChI InChI=1S/C14H18O4/c1-14(2)5-7-3-4-8(12(15)16)11-10(7)9(6-14)18-13(11)17/h3,8-11H,4-6H2,1-2H3,(H,15,16)/t8-,9+,10-,11-/m1/s1
InChIKey MEFHOHVQBDSOPL-LMLFDSFASA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UBr7fG1UDo
Name (2aS,3R,8aS,8bR)-7,7-Dimethyl-2-oxo-2a,3,4,6,7,8,8a,8b-octahydro-2H-benzo[cd]isobenzofuran-3-carboxylic acid
Alternate Name(s) (2aS,3R,8aS,8bR)-7,7-dimethyl-2-oxo-2a,3,4,6,7,8,8a,8b-octahydro-2H-naphtho[1,8-bc]furan-3-carboxylic acid (2aS,3R,8aS,8bR)-7,7-Dimethyl-2-oxo-2a,3,4,6,7,8,8a-octahydro-2H-benzo[cd]isobenzofuran-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-14(2)5-7-3-4-8(12(15)16)11-10(7)9(6-14)18-13(11)17/h3,8-11H,4-6H2,1-2H3,(H,15,16)/t8-,9+,10-,11-/m1/s1
InChIKey MEFHOHVQBDSOPL-LMLFDSFASA-N
Molecular Weight 250.294 g/mol
SMILES OC([C@]1([C@]2(C(O[C@]3(CC(C)(C)CC([C@@]23[H])=CC1)[H])=O)[H])[H])=O
SPLASH splash10-0f6x-9830000000-ad947254642100b330b7
Source of Spectrum B-53-408-6
Wiley ID 747025