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4-Methyl-5-(phenylthio)-7-oxabicyclo[2.2.1]hept-5-ene-2-exo,3-exo-dimethanol
SpectraBase Compound ID DGlaEgDB7Ye
InChI InChI=1S/C15H18O3S/c1-15-12(9-17)11(8-16)13(18-15)7-14(15)19-10-5-3-2-4-6-10/h2-7,11-13,16-17H,8-9H2,1H3/t11-,12-,13-,15+/m0/s1
InChIKey OHCQFLNPXMFWNC-PWNZVWSESA-N
Mol Weight 278.37 g/mol
Molecular Formula C15H18O3S
Exact Mass 278.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2VqkHyTEQF
Name 4-Methyl-5-(phenylthio)-7-oxabicyclo[2.2.1]hept-5-ene-2-exo,3-exo-dimethanol
CAS Registry Number 117626-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3S
InChI InChI=1S/C15H18O3S/c1-15-12(9-17)11(8-16)13(18-15)7-14(15)19-10-5-3-2-4-6-10/h2-7,11-13,16-17H,8-9H2,1H3/t11-,12-,13-,15+/m0/s1
InChIKey OHCQFLNPXMFWNC-PWNZVWSESA-N
Molecular Weight 278.366 g/mol
SMILES OC[C@]1([C@](CO)([C@@]2(C=C([C@@]1(O2)C)Sc1ccccc1)[H])[H])[H]
SPLASH splash10-0006-9200000000-c0e5861088cad4f1b650
Source of Spectrum J-54-96-24
Synonyms [3-(hydroxymethyl)-1-methyl-6-(phenylsulfanyl)-7-oxabicyclo[2.2.1]hept-5-en-2-yl]methanol
Wiley ID 1281848