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1-Methyl-7-oxabicyclo[2.2.1]hept-5-ene-2,3-dimethanol
SpectraBase Compound ID I3Pw56M9ku0
InChI InChI=1S/C9H14O3/c1-9-3-2-8(12-9)6(4-10)7(9)5-11/h2-3,6-8,10-11H,4-5H2,1H3/t6-,7+,8+,9-/m1/s1
InChIKey LSCMUUOXASZYCO-RYPBNFRJSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zfNOdfg41T
Name 1-Methyl-7-oxabicyclo[2.2.1]hept-5-ene-2,3-dimethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-9-3-2-8(12-9)6(4-10)7(9)5-11/h2-3,6-8,10-11H,4-5H2,1H3/t6-,7+,8+,9-/m1/s1
InChIKey LSCMUUOXASZYCO-RYPBNFRJSA-N
Molecular Weight 170.208 g/mol
SMILES OC[C@]1([C@@](CO)([C@]2(O[C@@]1(C=C2)C)[H])[H])[H]
SPLASH splash10-001i-9000000000-fe9d5423e6d654d170e0
Source of Spectrum B-51-415-27
Synonyms ((1R,2R,3S,4S)-3-Hydroxymethyl-1-methyl-7-oxa-bicyclo[2.2.1]hept-5-en-2-yl)-methanol [3-(hydroxymethyl)-1-methyl-7-oxabicyclo[2.2.1]hept-5-en-2-yl]methanol
Wiley ID 746132