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(1S*,3R*,6R*,7R*,10R*)-3-Methoxy-1,8,10-trimethyl-4-oxatricyclo[4.3.1.03,7]dec-8-en-2-one
SpectraBase Compound ID BLRB15ENGXL
InChI InChI=1S/C13H18O3/c1-7-5-12(3)8(2)9-6-16-13(15-4,10(7)9)11(12)14/h5,8-10H,6H2,1-4H3/t8-,9+,10-,12-,13+/m1/s1
InChIKey DRNVYSUPWCOOQG-TUFGJSMTSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmH9ZY7nlUW
Name (1S*,3R*,6R*,7R*,10R*)-3-Methoxy-1,8,10-trimethyl-4-oxatricyclo[4.3.1.03,7]dec-8-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-7-5-12(3)8(2)9-6-16-13(15-4,10(7)9)11(12)14/h5,8-10H,6H2,1-4H3/t8-,9+,10-,12-,13+/m1/s1
InChIKey DRNVYSUPWCOOQG-TUFGJSMTSA-N
Literature Reference DOI 10.1021/ol702062p
Molecular Weight 222.284 g/mol
SMILES C=1[C@]2(C(=O)[C@]3(OC[C@@]([C@]2(C)[H])([C@]3(C1C)[H])[H])OC)C
SPLASH splash10-000i-0900000000-6a3ee8442feb54c52c2c
Source of Spectrum A1-9-4563/SMS3-6
Synonyms (3R,3aR,6S,7aR,8R)-7a-methoxy-4,6,8-trimethyl-3,3a,6,7a-tetrahydro-3,6-methanobenzofuran-7(2H)-one
Wiley ID 1758722