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(2R,4R)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one

View entire compound with spectra: 3 MS (GC)

(2R,4R)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one
SpectraBase Compound ID 8t1sYVrs0YE
InChI InChI=1S/C9H12O2/c1-5-7-3-4-8(11-7)6(2)9(5)10/h3-8H,1-2H3/t5-,6-,7-,8+/m1/s1
InChIKey KGNKVSYYNPTFNH-XUTVFYLZSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LyBgok6TI2
Name 2,4-Dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one
CAS Registry Number 49747-05-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-5-7-3-4-8(11-7)6(2)9(5)10/h3-8H,1-2H3/t5-,6-,7-,8+/m1/s1
InChIKey KGNKVSYYNPTFNH-XUTVFYLZSA-N
Molecular Weight 152.193 g/mol
SMILES C[C@]1(C([C@@]([C@]2(C=C[C@@]1(O2)[H])[H])(C)[H])=O)[H]
SPLASH splash10-001j-9100000000-fcbb7e5b206826a0d9a8
Synonyms 8-Oxabicyclo[3.2.1]oct-6-en-3-one, 2,4-dimethyl-
Wiley ID 1499228