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(E,2R,3R)-3-hydroxy-5-iodo-2,4-dimethyl-4-pentenoic acid methyl ester
SpectraBase Compound ID GrRqyIRKtOp
InChI InChI=1S/C8H13IO3/c1-5(4-9)7(10)6(2)8(11)12-3/h4,6-7,10H,1-3H3/b5-4+/t6-,7+/m1/s1
InChIKey PFNDGLPPKRXAJA-ZVCMNORXSA-N
Mol Weight 284.09 g/mol
Molecular Formula C8H13IO3
Exact Mass 283.990939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTNM7II5yvz
Name (E,2R,3R)-3-hydroxy-5-iodo-2,4-dimethyl-4-pentenoic acid methyl ester
Alternate Name(s) (E,2R,3R)-3-hydroxy-5-iodo-2,4-dimethyl-pent-4-enoic acid methyl ester Methyl (E,2R,3R)-3-hydroxy-5-iodo-2,4-dimethyl-pent-4-enoate Methyl (E,2R,3R)-5-iodanyl-2,4-dimethyl-3-oxidanyl-pent-4-enoate
CAS Registry Number 123084-04-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13IO3
InChI InChI=1S/C8H13IO3/c1-5(4-9)7(10)6(2)8(11)12-3/h4,6-7,10H,1-3H3/b5-4+/t6-,7+/m1/s1
InChIKey PFNDGLPPKRXAJA-ZVCMNORXSA-N
Molecular Weight 284.093 g/mol
SMILES O[C@]([C@](C(=O)OC)(C)[H])(\C(=C\I)C)[H]
SPLASH splash10-05n0-4910000000-7b136f4fa31eaa740fbb
Source of Spectrum KC-1990-54-12
Wiley ID 1287305