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(2R,5R)-2,5-dimethyl-heptan-5-olide
SpectraBase Compound ID L6EsG3V0iw2
InChI InChI=1S/C9H16O2/c1-4-9(3)6-5-7(2)8(10)11-9/h7H,4-6H2,1-3H3/t7-,9-/m1/s1
InChIKey KXMUUSMNMBIDHO-VXNVDRBHSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1g4lmp2w0pq
Name (2R,5R)-2,5-dimethyl-heptan-5-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-4-9(3)6-5-7(2)8(10)11-9/h7H,4-6H2,1-3H3/t7-,9-/m1/s1
InChIKey KXMUUSMNMBIDHO-VXNVDRBHSA-N
Literature Reference DOI 10.1002_(SICI)1099-1026(199805_06)13_3_203
Molecular Weight 156.225 g/mol
SMILES C1C[C@@](CC)(OC([C@@]1(C)[H])=O)C
SPLASH splash10-0596-9100000000-457b1656f914821f50a1
Source of Spectrum FF-13-207-32_isomer_1
Synonyms (3R,6R)-6-ethyl-3,6-dimethyltetrahydro-2H-pyran-2-one
Wiley ID 1775177