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2-Fluoro-8-hydroxy-1,5-dimethyl-8-[4-(methoxycarbonyl-3-methyl)butadien-1-yl]-7-oxatricyclo[3.2.1]octan-3-one isomer
SpectraBase Compound ID 8NKBghqG4n5
InChI InChI=1S/C16H21FO5/c1-10(7-12(19)21-4)5-6-16(20)14(2)9-22-15(16,3)8-11(18)13(14)17/h5-7,13,20H,8-9H2,1-4H3/b6-5+,10-7-/t13-,14-,15+,16-/m1/s1
InChIKey CCGUWJSWPJSPGX-PCJFXMJSSA-N
Mol Weight 312.34 g/mol
Molecular Formula C16H21FO5
Exact Mass 312.137302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TBFgKKT9fc
Name 2-Fluoro-8-hydroxy-1,5-dimethyl-8-[4-(methoxycarbonyl-3-methyl)butadien-1-yl]-7-oxatricyclo[3.2.1]octan-3-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21FO5
InChI InChI=1S/C16H21FO5/c1-10(7-12(19)21-4)5-6-16(20)14(2)9-22-15(16,3)8-11(18)13(14)17/h5-7,13,20H,8-9H2,1-4H3/b6-5+,10-7-/t13-,14-,15+,16-/m1/s1
InChIKey CCGUWJSWPJSPGX-PCJFXMJSSA-N
Molecular Weight 312.337 g/mol
SMILES O[C@@]1([C@]2([C@@](C(=O)C[C@]1(C)OC2)(F)[H])C)\C=C\C(=C/C(=O)OC)C
SPLASH splash10-004i-0930000000-05a7db15849f93de8dc9
Source of Spectrum F-51-6925-10
Wiley ID 792145