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2H-Pyran-3(6H)-one, 4-iodo-2-methoxy-6-methyl-, (2R-trans)-
SpectraBase Compound ID CX3oNYMzUHc
InChI InChI=1S/C7H9IO3/c1-4-3-5(8)6(9)7(10-2)11-4/h3-4,7H,1-2H3/t4-,7+/m0/s1
InChIKey KTLQONSXVZFHBC-MHTLYPKNSA-N
Mol Weight 268.05 g/mol
Molecular Formula C7H9IO3
Exact Mass 267.959639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A25IXRuHuMW
Name 2H-Pyran-3(6H)-one, 4-iodo-2-methoxy-6-methyl-, (2R-trans)-
CAS Registry Number 55533-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9IO3
InChI InChI=1S/C7H9IO3/c1-4-3-5(8)6(9)7(10-2)11-4/h3-4,7H,1-2H3/t4-,7+/m0/s1
InChIKey KTLQONSXVZFHBC-MHTLYPKNSA-N
Molecular Weight 268.050 g/mol
SMILES C1(C(=C[C@@](O[C@]1(OC)[H])(C)[H])I)=O
SPLASH splash10-0zfr-9150000000-739160fbb71021c30f44
Source of Spectrum K-109-3914-0
Synonyms (2R,6S)-4-iodo-2-methoxy-6-methyl-2H-pyran-3(6H)-one Methyl-3-iodo-3,4,6-trideoxy-.alpha.-L-glycerohex-3-enopyranoside-2-ulose
Wiley ID 1271509