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2a,3a:8,13-diepoxy-2b-methoxylabdan-1-one
SpectraBase Compound ID 22EWkXkslx4
InChI InChI=1S/C21H34O4/c1-8-18(4)11-9-14-19(5,25-18)12-10-13-17(2,3)16-21(23-7,24-16)15(22)20(13,14)6/h13-14,16H,8-12H2,1-7H3/t13-,14-,16-,18-,19+,20-,21+/m0/s1
InChIKey SACUPSKMDYWKEK-NNAYTVAVSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CjFjv4NZkAp
Name 2a,3a:8,13-diepoxy-2b-methoxylabdan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-8-18(4)11-9-14-19(5,25-18)12-10-13-17(2,3)16-21(23-7,24-16)15(22)20(13,14)6/h13-14,16H,8-12H2,1-7H3/t13-,14-,16-,18-,19+,20-,21+/m0/s1
InChIKey SACUPSKMDYWKEK-NNAYTVAVSA-N
Molecular Weight 350.499 g/mol
SMILES [C@]12([C@](C(C)(C)[C@]3([C@](C2=O)([C@@]2([C@](O[C@](CC2)(CC)C)(CC3)C)[H])C)[H])(O1)[H])OC
SPLASH splash10-0fki-0019000000-9a606e19abb877622835
Source of Spectrum B-46-1125-0
Synonyms (3S,4aR,6aS,7aS,8aS,9aS,9bR)-3-ethyl-8a-methoxy-3,4a,7,7,9a-pentamethyldecahydro-1H-[1]benzoxireno[3,4-f]chromen-9(4aH)-one
Wiley ID 1342158