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1,3,3-Trimethyl-5-oxobicyclo[2.2.1]hept-2-yl acetate
SpectraBase Compound ID GF2fIjZv0Nh
InChI InChI=1S/C12H18O3/c1-7(13)15-10-11(2,3)8-5-12(10,4)6-9(8)14/h8,10H,5-6H2,1-4H3/t8-,10+,12+/m1/s1
InChIKey GHQYLDIEAGHXBP-QRTLGDNMSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mAd7xXgTWe
Name 1,3,3-Trimethyl-5-oxobicyclo[2.2.1]hept-2-yl acetate
CAS Registry Number 55590-79-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7(13)15-10-11(2,3)8-5-12(10,4)6-9(8)14/h8,10H,5-6H2,1-4H3/t8-,10+,12+/m1/s1
InChIKey GHQYLDIEAGHXBP-QRTLGDNMSA-N
Molecular Weight 210.273 g/mol
SMILES C(O[C@@]1([C@]2(C)CC([C@](C1(C)C)(C2)[H])=O)[H])(C)=O
SPLASH splash10-0aou-9600000000-a1fadc970e285fc6f925
Source of Spectrum AD-0-3433-0
Synonyms Bicyclo[2.2.1]heptan-2-one, 5-(acetyloxy)-4,6,6-trimethyl-, exo- Bicyclo[2.2.1]heptan-2-one, 5-(acetyloxy)-4,6,6-trimethyl-, endo- (1,3,3-trimethyl-5-oxo-norbornan-2-yl) acetate (2,2,4-trimethyl-6-oxidanylidene-3-bicyclo[2.2.1]heptanyl) ethanoate (2,2,4-trimethyl-6-oxo-3-bicyclo[2.2.1]heptanyl) acetate Acetic acid (2,2,4-trimethyl-6-oxo-3-bicyclo[2.2.1]heptanyl) ester Acetic acid (5-keto-1,3,3-trimethyl-norbornan-2-yl) ester
Wiley ID 26033