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1,4-Dioxaspiro[4.4]nonane-6-acetaldehyde, 7-(benzoyloxy)-6-methyl-, trans-
SpectraBase Compound ID 7ptx69Vf3HM
InChI InChI=1S/C17H20O5/c1-16(9-10-18)14(7-8-17(16)20-11-12-21-17)22-15(19)13-5-3-2-4-6-13/h2-6,10,14H,7-9,11-12H2,1H3/t14-,16+/m0/s1
InChIKey CNLXSEGJHLPUAW-GOEBONIOSA-N
Mol Weight 304.34 g/mol
Molecular Formula C17H20O5
Exact Mass 304.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfHnR3yYX90
Name 1,4-Dioxaspiro[4.4]nonane-6-acetaldehyde, 7-(benzoyloxy)-6-methyl-, trans-
Alternate Name(s) (6R,7S)-6-methyl-6-(2-oxoethyl)-1,4-dioxaspiro[4.4]non-7-yl benzoate 3,3-Ethylenedioxy-2-methyl-2-(2'-oxoethyl)cyclopent-1-yl benzoate 6-Methyl-6-formylmethyl-7-benzoyloxy-1,4-dioxaspiro[4.4]nonane
CAS Registry Number 123434-85-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O5
InChI InChI=1S/C17H20O5/c1-16(9-10-18)14(7-8-17(16)20-11-12-21-17)22-15(19)13-5-3-2-4-6-13/h2-6,10,14H,7-9,11-12H2,1H3/t14-,16+/m0/s1
InChIKey CNLXSEGJHLPUAW-GOEBONIOSA-N
Molecular Weight 304.342 g/mol
SMILES [C@]1(C2(OCCO2)CC[C@@]1(OC(=O)c1ccccc1)[H])(CC=O)C
SPLASH splash10-0540-5900000000-7e34a4844154d7cb3374
Source of Spectrum B-42-28-5
Wiley ID 1306452