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O-((1S)-1,5-Dimethylbicyclo[2.2.1]hept-5-en-2-endo-carbonyl)-D-pantolactone
SpectraBase Compound ID 28wDoNpBRd7
InChI InChI=1S/C16H22O4/c1-9-6-16(4)7-10(9)5-11(16)13(17)20-12-14(18)19-8-15(12,2)3/h6,10-12H,5,7-8H2,1-4H3/t10?,11?,12-,16+/m0/s1
InChIKey YJNFEXSTJYAUSE-SRFLYJQJSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17gctOPQ0Wp
Name O-((1S)-1,5-Dimethylbicyclo[2.2.1]hept-5-en-2-endo-carbonyl)-D-pantolactone
Alternate Name(s) (3R)-5-{[(1S)-1,5-dimethylbicyclo[2.2.1]hept-5-en-2-yl]carbonyl}-3-hydroxy-4,4-dimethyloxolan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-9-6-16(4)7-10(9)5-11(16)13(17)20-12-14(18)19-8-15(12,2)3/h6,10-12H,5,7-8H2,1-4H3/t10?,11?,12-,16+/m0/s1
InChIKey YJNFEXSTJYAUSE-SRFLYJQJSA-N
Molecular Weight 278.348 g/mol
SMILES [C@@]12(C(C(O[C@]3(C(OCC3(C)C)=O)[H])=O)CC(C1)C(=C2)C)C
SPLASH splash10-0006-9000000000-f2f7f510a78d432fda88
Source of Spectrum J-57-6574-7
Wiley ID 1282112