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4-Iodo-3a,7,7-trimethyloctahydroindan-2-one
SpectraBase Compound ID ACrpAw8efcO
InChI InChI=1S/C12H19IO/c1-11(2)5-4-10(13)12(3)7-8(14)6-9(11)12/h9-10H,4-7H2,1-3H3/t9?,10-,12-/m1/s1
InChIKey RYGLGIWDJUZJKP-UHFFFAOYSA-N
Mol Weight 306.19 g/mol
Molecular Formula C12H19IO
Exact Mass 306.04806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7gx0VzASpN
Name 4-Iodo-3a,7,7-trimethyloctahydroindan-2-one
Comments Removed - expert review: contamination (DOP)
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19IO
InChI InChI=1S/C12H19IO/c1-11(2)5-4-10(13)12(3)7-8(14)6-9(11)12/h9-10H,4-7H2,1-3H3/t9?,10-,12-/m1/s1
InChIKey RYGLGIWDJUZJKP-UHFFFAOYSA-N
Molecular Weight 306.187 g/mol
SMILES [C@@]12(C(C(C)(C)CC[C@]2(I)[H])CC(C1)=O)C
SPLASH splash10-006t-6920000000-4f1f01b192afb5b77bfe
Source of Spectrum F-55-857-23
Synonyms 4-iodo-3a,7,7-trimethyloctahydro-2H-inden-2-one
Wiley ID 836592