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(2S,2'S)-2'-iodo-3',4,4',5-tetrahydro-2'H,3H-spiro[furan-2,1'-naphthalene]
SpectraBase Compound ID GhpZHjf9cpq
InChI InChI=1S/C13H15IO/c14-12-7-6-10-4-1-2-5-11(10)13(12)8-3-9-15-13/h1-2,4-5,12H,3,6-9H2/t12-,13-/m0/s1
InChIKey WDYCRFPWFSDNKE-STQMWFEESA-N
Mol Weight 314.17 g/mol
Molecular Formula C13H15IO
Exact Mass 314.01676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWeejUSMYvo
Name (2S,2'S)-2'-iodo-3',4,4',5-tetrahydro-2'H,3H-spiro[furan-2,1'-naphthalene]
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15IO
InChI InChI=1S/C13H15IO/c14-12-7-6-10-4-1-2-5-11(10)13(12)8-3-9-15-13/h1-2,4-5,12H,3,6-9H2/t12-,13-/m0/s1
InChIKey WDYCRFPWFSDNKE-STQMWFEESA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202100605
Molecular Weight 314.166 g/mol
Optical Rotation [a]D20 = +29.2 (c = 0.85, CHCl3)
SMILES [C@@]12(OCCC2)c2c(CC[C@@]1(I)[H])cccc2
SPLASH splash10-000i-0900000000-55adc3930ec3a3b56adb
Sample Comments er = 74:26
Source of Spectrum ASC-363-SM27-14b
Wiley ID 1851271