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8,13-epoxy-2-methoxylabd-1-en-3-one
SpectraBase Compound ID KmCDeYkkb62
InChI InChI=1S/C21H34O3/c1-8-19(4)11-9-16-20(5)13-14(23-7)17(22)18(2,3)15(20)10-12-21(16,6)24-19/h13,15-16H,8-12H2,1-7H3/t15-,16+,19-,20-,21+/m0/s1
InChIKey DFEXHDPWJGDRCN-CEDHKZHLSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nU2MRLEg2s
Name 8,13-epoxy-2-methoxylabd-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-8-19(4)11-9-16-20(5)13-14(23-7)17(22)18(2,3)15(20)10-12-21(16,6)24-19/h13,15-16H,8-12H2,1-7H3/t15-,16+,19-,20-,21+/m0/s1
InChIKey DFEXHDPWJGDRCN-CEDHKZHLSA-N
Molecular Weight 334.500 g/mol
SMILES [C@]12(C=C(OC)C(C([C@@]2(CC[C@@]2([C@@]1(CC[C@@](CC)(C)O2)[H])C)[H])(C)C)=O)C
SPLASH splash10-00lr-0009000000-b72b0b9a9737d59013d6
Source of Spectrum B-46-1125-0
Synonyms (3S,4aR,6aR,10aR,10bR)-3-ethyl-9-methoxy-3,4a,7,7,10a-pentamethyl-2,3,5,6,6a,7,10a,10b-octahydro-1H-benzo[f]chromen-8(4aH)-one
Wiley ID 1331349