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4H-Cyclopentoxazol-4-ol, 3a,5,6,6a-tetrahydro-4-methyl-2-phenyl-, (3a.alpha.,4.alpha.,6a.alpha.)-
SpectraBase Compound ID DyUVnFf2f5L
InChI InChI=1S/C13H15NO2/c1-13(15)8-7-10-11(13)14-12(16-10)9-5-3-2-4-6-9/h2-6,10-11,15H,7-8H2,1H3/t10-,11-,13+/m1/s1
InChIKey PAUWNINECGKXJI-WZRBSPASSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBNBSKkrO41
Name 4H-Cyclopentoxazol-4-ol, 3a,5,6,6a-tetrahydro-4-methyl-2-phenyl-, (3a.alpha.,4.alpha.,6a.alpha.)-
CAS Registry Number 86288-44-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-13(15)8-7-10-11(13)14-12(16-10)9-5-3-2-4-6-9/h2-6,10-11,15H,7-8H2,1H3/t10-,11-,13+/m1/s1
InChIKey PAUWNINECGKXJI-WZRBSPASSA-N
Molecular Weight 217.268 g/mol
SMILES O[C@@]1([C@@]2(N=C(O[C@@]2(CC1)[H])c1ccccc1)[H])C
SPLASH splash10-0a4i-2900000000-b172aec7c48bf22575c5
Source of Spectrum J-48-2865-0
Synonyms (3a.alpha.,4.alpha.,6a.alpha.)-3a,5,6,6a-tetrahydro-4-methyl-2-phenyl-4H-cyclopentoxazol-4-ol (3aR,4S,6aR)-4-methyl-2-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-4-ol
Wiley ID 1216643