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(1R*,2S*,5Z,10S*,12S)-12-Acetoxy-9-iodo-13-oxabicyclo[8,2.1]tridec-5-en-2-ol
SpectraBase Compound ID DiDTwK1Engc
InChI InChI=1S/C14H21IO4/c1-9(16)18-13-8-12-10(15)6-4-2-3-5-7-11(17)14(13)19-12/h2-3,10-14,17H,4-8H2,1H3/b3-2-/t10?,11-,12-,13+,14+/m1/s1
InChIKey SZQUTYJOIYPDQP-WQJZRTNSSA-N
Mol Weight 380.22 g/mol
Molecular Formula C14H21IO4
Exact Mass 380.048454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EHNsJCQVFt
Name (1R*,2S*,5Z,10S*,12S)-12-Acetoxy-9-iodo-13-oxabicyclo[8,2.1]tridec-5-en-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21IO4
InChI InChI=1S/C14H21IO4/c1-9(16)18-13-8-12-10(15)6-4-2-3-5-7-11(17)14(13)19-12/h2-3,10-14,17H,4-8H2,1H3/b3-2-/t10?,11-,12-,13+,14+/m1/s1
InChIKey SZQUTYJOIYPDQP-WQJZRTNSSA-N
Molecular Weight 380.222 g/mol
SMILES O[C@]1([C@@]2(O[C@](C[C@@]2(OC(=O)C)[H])(C(I)CC\C=C/CC1)[H])[H])[H]
SPLASH splash10-00l6-9611000000-eb675e2acb2d367c1219
Source of Spectrum J-59-2873-122
Synonyms (1R,9R,10S,11S)-9-hydroxy-2-iodo-13-oxabicyclo[8.2.1]tridec-5-en-11-yl acetate
Wiley ID 1359472