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trans-6-(Iodomethyl)-2-tert-butylhexanolide
SpectraBase Compound ID FSPwyZVnJF6
InChI InChI=1S/C11H19IO2/c1-11(2,3)9-6-4-5-8(7-12)14-10(9)13/h8-9H,4-7H2,1-3H3/t8-,9+/m0/s1
InChIKey UIQPRGWPUGJLSA-DTWKUNHWSA-N
Mol Weight 310.18 g/mol
Molecular Formula C11H19IO2
Exact Mass 310.042975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FqK6kIESMvc
Name trans-6-(Iodomethyl)-2-tert-butylhexanolide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19IO2
InChI InChI=1S/C11H19IO2/c1-11(2,3)9-6-4-5-8(7-12)14-10(9)13/h8-9H,4-7H2,1-3H3/t8-,9+/m0/s1
InChIKey UIQPRGWPUGJLSA-DTWKUNHWSA-N
Molecular Weight 310.175 g/mol
SMILES C1(O[C@](CI)(CCC[C@]1(C(C)(C)C)[H])[H])=O
SPLASH splash10-053u-9000000000-a6d85c6c3934e6888632
Source of Spectrum J-59-5916-5
Synonyms (3S,7S)-3-tert-butyl-7-(iodomethyl)-2-oxepanone
Wiley ID 1311037