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2(S)-(1-bornyloxy)-3(S)-hydroxy-4(S)-(phenylseleno)tetrahydropyran
SpectraBase Compound ID JUmJ4SIS7PV
InChI InChI=1S/C21H30O3Se/c1-20(2)15-9-11-21(20,3)13-16(15)24-19-18(22)17(10-12-23-19)25-14-7-5-4-6-8-14/h4-8,15-19,22H,9-13H2,1-3H3/t15-,16?,17-,18+,19-,21+/m0/s1
InChIKey HDHJJPHYBNGNDW-NFJSOFGFSA-N
Mol Weight 409.44 g/mol
Molecular Formula C21H30O3Se
Exact Mass 410.136017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67ZyfgaGPP0
Name 2(S)-(1-bornyloxy)-3(S)-hydroxy-4(S)-(phenylseleno)tetrahydropyran
Alternate Name(s) 4,7,7-trimethylbicyclo[2.2.1]hept-2-yl 4-deoxy-3-Se-phenyl-3-seleno-.alpha.-L-threo-pentopyranoside
CAS Registry Number 100703-50-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3Se
InChI InChI=1S/C21H30O3Se/c1-20(2)15-9-11-21(20,3)13-16(15)24-19-18(22)17(10-12-23-19)25-14-7-5-4-6-8-14/h4-8,15-19,22H,9-13H2,1-3H3/t15-,16?,17-,18+,19-,21+/m0/s1
InChIKey HDHJJPHYBNGNDW-NFJSOFGFSA-N
Molecular Weight 409.440 g/mol
SMILES O[C@]1([C@](OC2C[C@@]3(C([C@]2(CC3)[H])(C)C)C)(OCC[C@@]1([Se]c1ccccc1)[H])[H])[H]
SPLASH splash10-000i-0900000000-d1096adcb40d7c0b6772
Source of Spectrum J-53-5916-17
Wiley ID 1373574