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Bicyclo[2.2.1]heptan-2-one, 5-(acetyloxy)-3-hydroxy-4,7,7-trimethyl-, [1R-(3-endo,5-exo)]-
SpectraBase Compound ID 3w7DaVdqhhC
InChI InChI=1S/C12H18O4/c1-6(13)16-8-5-7-9(14)10(15)12(8,4)11(7,2)3/h7-8,10,15H,5H2,1-4H3/t7-,8+,10?,12+/m1/s1
InChIKey OWMYXJHJIYICLI-WRSGUPDDSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TPVIiJjqxe
Name Bicyclo[2.2.1]heptan-2-one, 5-(acetyloxy)-3-hydroxy-4,7,7-trimethyl-, [1R-(3-endo,5-exo)]-
Alternate Name(s) (-)-5-Oxo-6-endo-hydroxyisobornyl acetate 6-Hydroxy-1,7,7-trimethyl-5-oxobicyclo[2.2.1]hept-2-yl acetate
CAS Registry Number 70591-41-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-6(13)16-8-5-7-9(14)10(15)12(8,4)11(7,2)3/h7-8,10,15H,5H2,1-4H3/t7-,8+,10?,12+/m1/s1
InChIKey OWMYXJHJIYICLI-WRSGUPDDSA-N
Molecular Weight 226.272 g/mol
SMILES OC1[C@]2(C([C@](C[C@@]2(OC(=O)C)[H])(C1=O)[H])(C)C)C
SPLASH splash10-009i-0900000000-359fb306907412a8c8f0
Source of Spectrum I-57-745-0
Wiley ID 1227266