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6-Oxabicyclo[3.2.1]octan-7-one, 1-(1-hydroxy-1,5-dimethyl-4-hexenyl)-4-iodo-4-methyl-, [1.alpha.(R*),4.beta.,5.beta.]-(.+-.)-
SpectraBase Compound ID GJByf6fcQVW
InChI InChI=1S/C16H25IO3/c1-11(2)6-5-7-15(4,19)16-9-8-14(3,17)12(10-16)20-13(16)18/h6,12,19H,5,7-10H2,1-4H3/t12-,14-,15?,16-/m0/s1
InChIKey IWAOMWIVLHWZDP-IIQYYHDJSA-N
Mol Weight 392.28 g/mol
Molecular Formula C16H25IO3
Exact Mass 392.08484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fpk9fNDE2OW
Name 6-Oxabicyclo[3.2.1]octan-7-one, 1-(1-hydroxy-1,5-dimethyl-4-hexenyl)-4-iodo-4-methyl-, [1.alpha.(R*),4.beta.,5.beta.]-(.+-.)-
Alternate Name(s) 6-Oxabicyclo[3.2.1]octan-7-one, 1-(1-hydroxy-1,5-dimethyl-4-hexenyl)-4-iodo-4-methyl-, [1.alpha.(S*),4.beta.,5.beta.]-(.+-.)- (1R,4S,5S)-1-(1-hydroxy-1,5-dimethyl-4-hexenyl)-4-iodo-4-methyl-6-oxabicyclo[3.2.1]octan-7-one
CAS Registry Number 94294-69-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25IO3
InChI InChI=1S/C16H25IO3/c1-11(2)6-5-7-15(4,19)16-9-8-14(3,17)12(10-16)20-13(16)18/h6,12,19H,5,7-10H2,1-4H3/t12-,14-,15?,16-/m0/s1
InChIKey IWAOMWIVLHWZDP-IIQYYHDJSA-N
Molecular Weight 392.277 g/mol
SMILES OC([C@@]12C(O[C@](C2)([H])[C@](CC1)(I)C)=O)(CCC=C(C)C)C
SPLASH splash10-0072-0940000000-a75a6a05d3698032ce0e
Source of Spectrum C-108-7807-0
Wiley ID 1365605