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(2R,5R,6S)-5-methyl-4-oxa-exo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
SpectraBase Compound ID LHvkIRRA5VK
InChI InChI=1S/C10H12O2/c1-5-8-6-2-3-7(4-6)9(8)10(11)12-5/h2-3,5-9H,4H2,1H3/t5-,6?,7?,8+,9-/m1/s1
InChIKey BQQYWSCMHJRHQG-WLVPEFEWSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UhBDYvSFXC
Name (2R,5R,6S)-5-methyl-4-oxa-exo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
CAS Registry Number 111613-19-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-5-8-6-2-3-7(4-6)9(8)10(11)12-5/h2-3,5-9H,4H2,1H3/t5-,6?,7?,8+,9-/m1/s1
InChIKey BQQYWSCMHJRHQG-WLVPEFEWSA-N
Molecular Weight 164.204 g/mol
SMILES C1(O[C@](C)([C@]2(C3C=CC([C@@]12[H])C3)[H])[H])=O
SPLASH splash10-00kf-9000000000-8fc7d13114b0294f782e
Source of Spectrum F-45-1837-5
Synonyms (2R,5R,6S)-5-methyl-4-oxa-endo-tricyclo[.2.1.0(2,6)]dec-8-en-3-one (2R,5R,6S)-5-methyl-4-oxatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
Wiley ID 1160447