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1,4,7,10-Tetraoxacyclotridecane, 12-dodecyl-12-methyl-
SpectraBase Compound ID 5P2AmhZN5DN
InChI InChI=1S/C22H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-22(2)20-25-18-16-23-14-15-24-17-19-26-21-22/h3-21H2,1-2H3
InChIKey XZXSXDASMVDZQT-UHFFFAOYSA-N
Mol Weight 372.6 g/mol
Molecular Formula C22H44O4
Exact Mass 372.32396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18ltxLJdcq1
Name 1,4,7,10-Tetraoxacyclotridecane, 12-dodecyl-12-methyl-
Alternate Name(s) 12-Dodecyl-12-methyl-1,4,7,10-tetraoxacyclotridecane Dodecyl-methyl-13-crown-4
CAS Registry Number 92144-65-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H44O4
InChI InChI=1S/C22H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-22(2)20-25-18-16-23-14-15-24-17-19-26-21-22/h3-21H2,1-2H3
InChIKey XZXSXDASMVDZQT-UHFFFAOYSA-N
Molecular Weight 372.590 g/mol
SMILES C1(COCCOCCOCCOC1)(CCCCCCCCCCCC)C
SPLASH splash10-0002-9000000000-9c08ae643bad32d2a91e
Source of Spectrum C-106-6982-0
Wiley ID 1355649