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1-ALPHA-ACETOXY-6-BETA-ISOBUTYROXY-9-OXO-10-ALPHA-H-FURANOEREMOPHILANE
SpectraBase Compound ID 6UiseHpvtmB
InChI InChI=1S/C21H28O6/c1-10(2)20(24)27-19-15-11(3)9-25-18(15)17(23)16-14(26-13(5)22)8-7-12(4)21(16,19)6/h9-10,12,14,16,19H,7-8H2,1-6H3/t12-,14-,16-,19+,21+/m0/s1
InChIKey BSVVKCYFWUIZLC-ABNNWSJISA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40df6czbFky
Name 1alpha-Acetoxy-6beta-isobutyryloxy-9-oxo-10alphaH-furanoeremophilane
Alternate Name(s) (4S,4aR,5S,8S,8aS)-8-acetoxy-3,4a,5-trimethyl-9-oxo-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-4-yl isobutyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-10(2)20(24)27-19-15-11(3)9-25-18(15)17(23)16-14(26-13(5)22)8-7-12(4)21(16,19)6/h9-10,12,14,16,19H,7-8H2,1-6H3/t12-,14-,16-,19+,21+/m0/s1
InChIKey BSVVKCYFWUIZLC-ABNNWSJISA-N
Literature Reference DOI 10.1002/cber.19741070913
Molecular Weight 376.449 g/mol
SMILES C1[C@@]([C@@]2([C@@]([C@](C1)(C)[H])([C@@](c1c(C2=O)occ1C)(OC(C(C)C)=O)[H])C)[H])(OC(=O)C)[H]
SPLASH splash10-024j-4090000000-d4f2a25472e4cb04c475
Source of Spectrum K-107-2921-15
Wiley ID 1793793