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endo-2-(2-tetrahydropyranyloxy)-exo-7-deuterio-9-oxabicyclo(3.3.1)nonan-exo-6-ol
SpectraBase Compound ID iryy0DOj27
InChI InChI=1S/C13H22O4/c14-9-4-5-11-12(7-6-10(9)16-11)17-13-3-1-2-8-15-13/h9-14H,1-8H2/t9-,10+,11+,12+,13?/m1/s1/i4D/t4-,9-,10+,11+,12+,13?
InChIKey JAQYNKUPLYTELP-VXXQDPLZSA-N
Mol Weight 243.32 g/mol
Molecular Formula C13H21DO4
Exact Mass 243.158086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0OPsuRX66E
Name endo-2-(2-tetrahydropyranyloxy)-exo-7-deuterio-9-oxabicyclo(3.3.1)nonan-exo-6-ol
CAS Registry Number 60378-26-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21DO4
InChI InChI=1S/C13H22O4/c14-9-4-5-11-12(7-6-10(9)16-11)17-13-3-1-2-8-15-13/h9-14H,1-8H2/t9-,10+,11+,12+,13?/m1/s1/i4D/t4-,9-,10+,11+,12+,13?
InChIKey JAQYNKUPLYTELP-VXXQDPLZSA-N
Molecular Weight 243.321 g/mol
SMILES O[C@]1([C@]2(O[C@]([C@@](OC3OCCCC3)(CC2)[H])(C[C@]1([D])[H])[H])[H])[H]
SPLASH splash10-000i-9100000000-dc24a4e4ca68baa9ec48
Source of Spectrum H-59-433-24
Synonyms 9-Oxabicyclo[3.3.1]nonan-7-d-6-ol, 2-[(tetrahydro-2H-pyran-2-yl)oxy]-
Wiley ID 1244986