SpectraBase Compound ID | 4R8y8E5h61R |
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InChI | InChI=1S/C11H17IO/c1-10(2)6-9(13)8-4-3-5-11(8,10)7-12/h8H,3-7H2,1-2H3 |
InChIKey | SNGUUYOSKIYACV-UHFFFAOYSA-N |
Mol Weight | 292.16 g/mol |
Molecular Formula | C11H17IO |
Exact Mass | 292.03241 g/mol |
SpectraBase Spectrum ID | 11EZ5il0fbH |
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Name | 3a-(Iodomethyl)-3,3-dimethylhexahydro-1(2H)-pentalenone |
CAS Registry Number | 121402-84-4 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H17IO |
InChI | InChI=1S/C11H17IO/c1-10(2)6-9(13)8-4-3-5-11(8,10)7-12/h8H,3-7H2,1-2H3 |
InChIKey | SNGUUYOSKIYACV-UHFFFAOYSA-N |
Molecular Weight | 292.160 g/mol |
SMILES | C12CCCC2(C(C)(C)CC1=O)CI |
SPLASH | splash10-00lr-8900000000-538e815f3bf136b9ea1f |
Source of Spectrum | F-45-4948-8 |
Synonyms | (3aR,6aS)-3,3-dimethyl-3a-iodomethyl-3,3a,4,5,6a-hexahydropentalen-1(2H)-one 3a-(iodanylmethyl)-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one 3a-(iodomethyl)-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one |
Wiley ID | 1294955 |