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Cyclopentaneacetic acid, 4-(iodomethyl)-2-oxo-, ethyl ester, trans-(.+-.)-
SpectraBase Compound ID LXswyGqDUGt
InChI InChI=1S/C10H15IO3/c1-2-14-10(13)5-8-3-7(6-11)4-9(8)12/h7-8H,2-6H2,1H3/t7-,8+/m1/s1
InChIKey RKAGVHVNOYOPPL-SFYZADRCSA-N
Mol Weight 310.13 g/mol
Molecular Formula C10H15IO3
Exact Mass 310.006589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4X6gxlT7Q6C
Name Cyclopentaneacetic acid, 4-(iodomethyl)-2-oxo-, ethyl ester, trans-(.+-.)-
CAS Registry Number 123559-39-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15IO3
InChI InChI=1S/C10H15IO3/c1-2-14-10(13)5-8-3-7(6-11)4-9(8)12/h7-8H,2-6H2,1H3/t7-,8+/m1/s1
InChIKey RKAGVHVNOYOPPL-SFYZADRCSA-N
Molecular Weight 310.131 g/mol
SMILES C1([C@](CC(=O)OCC)(C[C@](C1)(CI)[H])[H])=O
SPLASH splash10-000i-0922000000-f4c24dd83eabd5937d59
Source of Spectrum F-45-1402-9
Synonyms (+-)-(1'R*,4S*)-ethyl-4'-iodomethyl-2'-oxocyclopentylacetate) Ethyl[(1S,4R)-4-(iodomethyl)-2-oxocyclopentyl]acetate
Wiley ID 1310991