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(1R,3S)-Di-tert-Butoxy-(3aS)-methyl-6-oxo-2,3,3a,4,5,6-hexahydro-1H-inden-(5R)-yl acetate
SpectraBase Compound ID XKaVSnEZzx
InChI InChI=1S/C20H32O5/c1-12(21)23-16-11-20(8)13(9-14(16)22)15(24-18(2,3)4)10-17(20)25-19(5,6)7/h9,15-17H,10-11H2,1-8H3/t15-,16-,17+,20+/m1/s1
InChIKey MJRJWZYIRPJHDY-WWNBULGVSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5N0NdSYeufb
Name (1R,3S)-Di-tert-Butoxy-(3aS)-methyl-6-oxo-2,3,3a,4,5,6-hexahydro-1H-inden-(5R)-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-12(21)23-16-11-20(8)13(9-14(16)22)15(24-18(2,3)4)10-17(20)25-19(5,6)7/h9,15-17H,10-11H2,1-8H3/t15-,16-,17+,20+/m1/s1
InChIKey MJRJWZYIRPJHDY-WWNBULGVSA-N
Molecular Weight 352.471 g/mol
SMILES C=12[C@@]([C@@](OC(C)(C)C)(C[C@]2(OC(C)(C)C)[H])[H])(C[C@](C(C1)=O)(OC(=O)C)[H])C
SPLASH splash10-052b-4190000000-70600df3eaa2fb79ed64
Source of Spectrum KD-16-1012-37
Synonyms (1R,3S,3aS,5R)-1,3-ditert-butoxy-3a-methyl-6-oxo-2,3,3a,4,5,6-hexahydro-1H-inden-5-yl acetate
Wiley ID 1637537