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9-Dodecylanthroate

View entire compound with spectra: 1 NMR, and 2 MS (GC)

9-Dodecylanthroate
SpectraBase Compound ID NuuKQwUWKk
InChI InChI=1S/C27H34O2/c1-2-3-4-5-6-7-8-9-10-15-20-29-27(28)26-24-18-13-11-16-22(24)21-23-17-12-14-19-25(23)26/h11-14,16-19,21H,2-10,15,20H2,1H3
InChIKey DNLXMPFOALHROH-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C27H34O2
Exact Mass 390.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID avKDzZRtHq
Name 9-DODECYLANTHROATE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C27H34O2
InChI InChI=1S/C27H34O2/c1-2-3-4-5-6-7-8-9-10-15-20-29-27(28)26-24-18-13-11-16-22(24)21-23-17-12-14-19-25(23)26/h11-14,16-19,21H,2-10,15,20H2,1H3
InChIKey DNLXMPFOALHROH-UHFFFAOYSA-N
Instrument Name MAT CH5
Molecular Weight 390.2550
SMILES c1cc2cc3ccccc3c(C(OCCCCCCCCCCCC)=O)c2cc1
SPLASH splash10-0006-8789000000-4338fbc012ffe1f4e4b1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany