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3-Benzyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,5,9-trione
SpectraBase Compound ID 1G04I9aJjpQ
InChI InChI=1S/C19H24O9/c20-17-13-25-14-18(21)28-16(12-15-4-2-1-3-5-15)19(22)27-11-9-24-7-6-23-8-10-26-17/h1-5,16H,6-14H2
InChIKey BGRMZNVKZGJVSJ-UHFFFAOYSA-N
Mol Weight 396.39 g/mol
Molecular Formula C19H24O9
Exact Mass 396.142032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aEvzRdI8nI
Name 3-Benzyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,5,9-trione
CAS Registry Number 79687-37-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O9
InChI InChI=1S/C19H24O9/c20-17-13-25-14-18(21)28-16(12-15-4-2-1-3-5-15)19(22)27-11-9-24-7-6-23-8-10-26-17/h1-5,16H,6-14H2
InChIKey BGRMZNVKZGJVSJ-UHFFFAOYSA-N
Molecular Weight 396.392 g/mol
SMILES c1ccc(cc1)CC1C(=O)OCCOCCOCCOC(COCC(=O)O1)=O
SPLASH splash10-0gx0-4900000000-a1a3fe8c8c9e4d569e4a
Source of Spectrum W5-1989-37166-28370
Synonyms 3-(Phenylmethyl)-1,4,7,10,13,16-hexaoxacyclooctadecane-2,5,9-trione
Wiley ID 1367337