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2H-2,4a-Ethenonaphtho[2,1-c][1,2]dioxin-7-carboxylic acid, 1,5,6,6a,7,8,9,10,10a,10b-decahydro-7,10a-dimethyl-12-(1-methylethyl)-, methyl ester, [2S-(2.alpha.,4a.alpha.,6a.beta.,7.beta.,10a.alpha.,10b.beta.)]-
SpectraBase Compound ID GkqSjqLKxjt
InChI InChI=1S/C21H32O4/c1-13(2)14-12-21-10-7-16-19(3,17(21)11-15(14)24-25-21)8-6-9-20(16,4)18(22)23-5/h12-13,15-17H,6-11H2,1-5H3/t15-,16+,17?,19-,20+,21+/m1/s1
InChIKey NAAKMWGAXDJMGM-AMNKKOKOSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6Y3g9gjrn3
Name 2H-2,4a-Ethenonaphtho[2,1-c][1,2]dioxin-7-carboxylic acid, 1,5,6,6a,7,8,9,10,10a,10b-decahydro-7,10a-dimethyl-12-(1-methylethyl)-, methyl ester, [2S-(2.alpha.,4a.alpha.,6a.beta.,7.beta.,10a.alpha.,10b.beta.)]-
CAS Registry Number 55528-88-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-13(2)14-12-21-10-7-16-19(3,17(21)11-15(14)24-25-21)8-6-9-20(16,4)18(22)23-5/h12-13,15-17H,6-11H2,1-5H3/t15-,16+,17?,19-,20+,21+/m1/s1
InChIKey NAAKMWGAXDJMGM-AMNKKOKOSA-N
Molecular Weight 348.483 g/mol
SMILES [C@@]123C([C@@]4(CCC[C@@]([C@]4(CC3)[H])(C(=O)OC)C)C)C[C@](OO2)([H])C(=C1)C(C)C
SPLASH splash10-014i-0309000000-5efa18ede169bba72cd4
Source of Spectrum I-66-1679-4
Synonyms Methyl (1S,4S,5S,9R,12R)-16-isopropyl-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.0(1,10).0(4,9)]hexadec-15-ene-5-carboxylate Methyl 8.alpha.,12.alpha.-epidioxyabiet-13-enate
Wiley ID 1340851