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(2R*,3S*)-2-(1-cyclohexenylmethoxy)-3-iodo-tetrahydro-2H-pyran
SpectraBase Compound ID 3W183kLkERJ
InChI InChI=1S/C12H19IO2/c13-11-7-4-8-14-12(11)15-9-10-5-2-1-3-6-10/h5,11-12H,1-4,6-9H2/t11-,12+/m0/s1
InChIKey SCAANTPPGSOKAJ-NWDGAFQWSA-N
Mol Weight 322.19 g/mol
Molecular Formula C12H19IO2
Exact Mass 322.042975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApHLp1odkwz
Name (2R*,3S*)-2-(1-cyclohexenylmethoxy)-3-iodo-tetrahydro-2H-pyran
Appearance Colourless oil
Carrier Gas Helium (1.4 ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.042974850 u
Formula C12H19IO2
GC Column Macherey-Nagel Optima delta-3 (20 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C12H19IO2/c13-11-7-4-8-14-12(11)15-9-10-5-2-1-3-6-10/h5,11-12H,1-4,6-9H2/t11-,12+/m0/s1
InChIKey SCAANTPPGSOKAJ-NWDGAFQWSA-N
Inlet Type Split
Instrument Name Finnigan Trace GC/MS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201604950
Molecular Weight 322.186 g/mol
Quality 181
Reported Formula C12H19O2I
SMILES C1O[C@@]([C@](CC1)(I)[H])(OCC=1CCCCC1)[H]
SPLASH splash10-0002-9000000000-d21a337b7029c7729bbb
Source of Spectrum ACI-55-SM16-8d (DOI: 10.1002/anie.201604950)
Wiley ID 1899225