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3,7,11-trimethyl-12-dodecanolide

View entire compound with spectra: 2 MS (GC)

3,7,11-trimethyl-12-dodecanolide
SpectraBase Compound ID HrwUxjxkafQ
InChI InChI=1S/C15H28O2/c1-12-6-4-8-13(2)10-15(16)17-11-14(3)9-5-7-12/h12-14H,4-11H2,1-3H3
InChIKey DWTWVGCLKGMDFI-UHFFFAOYSA-N
Mol Weight 240.39 g/mol
Molecular Formula C15H28O2
Exact Mass 240.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID P7LIpZs6S
Name 4,8,12-trimethyl-oxacyclotridecan-2-one
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.208930140 u
Formula C15H28O2
InChI InChI=1S/C15H28O2/c1-12-6-4-8-13(2)10-15(16)17-11-14(3)9-5-7-12/h12-14H,4-11H2,1-3H3
InChIKey DWTWVGCLKGMDFI-UHFFFAOYSA-N
Instrument Name HP 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800199
Molecular Weight 240.387 g/mol
Quality 1000
SMILES C1C(CCCC(CCCC(COC1=O)C)C)C
SPLASH splash10-0aou-9400000000-f2e90ec67a64e8a12bea
Source of Spectrum K1-2018-2652-Figure 4 B (DOI: 10.1002/ejoc.201800199)
Wiley ID 1894060