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(2S)-2-[(R)-1-Hydroxy-1-formylethyl]-N-[(E)-2-iodo-4-methyl-2-octenyl]pyrrolidine
SpectraBase Compound ID KMsTnXoTSsX
InChI InChI=1S/C16H28INO2/c1-4-5-7-13(2)10-14(17)11-18-9-6-8-15(18)16(3,20)12-19/h10,12-13,15,20H,4-9,11H2,1-3H3/b14-10+/t13?,15-,16-/m0/s1
InChIKey HCGVOSOEUZDJKB-GJOFXWFJSA-N
Mol Weight 393.31 g/mol
Molecular Formula C16H28INO2
Exact Mass 393.116474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lj3VkAMkn5T
Name (2S)-2-[(R)-1-Hydroxy-1-formylethyl]-N-[(E)-2-iodo-4-methyl-2-octenyl]pyrrolidine
Alternate Name(s) (2R)-2-hydroxy-2-{(2S)-1-[(2E)-2-iodo-4-methyl-2-octenyl]pyrrolidinyl}propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28INO2
InChI InChI=1S/C16H28INO2/c1-4-5-7-13(2)10-14(17)11-18-9-6-8-15(18)16(3,20)12-19/h10,12-13,15,20H,4-9,11H2,1-3H3/b14-10+/t13?,15-,16-/m0/s1
InChIKey HCGVOSOEUZDJKB-GJOFXWFJSA-N
Molecular Weight 393.309 g/mol
SMILES O[C@]([C@]1(N(C\C(=C/C(CCCC)C)I)CCC1)[H])(C=O)C
SPLASH splash10-00di-0209000000-91a40c91efde735cea98
Source of Spectrum C-115-11404-50
Wiley ID 1366162