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2H-Pyran-2-one, tetrahydro-5,6-dimethyl-4-[(phenylseleno)methyl]-, (4.alpha.,5.beta.,6.beta.)-(.+-.)-
SpectraBase Compound ID KRJVYRyYxSS
InChI InChI=1S/C14H18O2Se/c1-10-11(2)16-14(15)8-12(10)9-17-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey APUOERYUWLUKSJ-QJPTWQEYSA-N
Mol Weight 297.27 g/mol
Molecular Formula C14H18O2Se
Exact Mass 298.047202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uNGgfJ5frw
Name 2H-Pyran-2-one, tetrahydro-5,6-dimethyl-4-[(phenylseleno)methyl]-, (4.alpha.,5.beta.,6.beta.)-(.+-.)-
CAS Registry Number 111194-12-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2Se
InChI InChI=1S/C14H18O2Se/c1-10-11(2)16-14(15)8-12(10)9-17-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey APUOERYUWLUKSJ-QJPTWQEYSA-N
Molecular Weight 297.268 g/mol
SMILES C1(O[C@@]([C@@]([C@](C1)(C[Se]c1ccccc1)[H])(C)[H])(C)[H])=O
SPLASH splash10-05mk-9240000000-8b4417ba9d288e483699
Source of Spectrum F-46-1762-20
Synonyms (4S*,5R*,6R*)-5,6-dimethyl-4-phenylselenomethyltetrahydro-2H-pyrran-2-one (4S,5R,6R)-5,6-dimethyl-4-[(phenylselanyl)methyl]tetrahydro-2H-pyran-2-one
Wiley ID 1300643