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2-Phenylethyl tricosanoate

View entire compound with spectra: 1 MS (GC)

2-Phenylethyl tricosanoate
SpectraBase Compound ID C0aKM84wATk
InChI InChI=1S/C31H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-31(32)33-29-28-30-25-22-21-23-26-30/h21-23,25-26H,2-20,24,27-29H2,1H3
InChIKey URXXFQRMWBGDRI-UHFFFAOYSA-N
Mol Weight 458.8 g/mol
Molecular Formula C31H54O2
Exact Mass 458.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GONAzfUeOjB
Name 2-Phenylethyl tricosanoate
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 458.412380977 u
Formula C31H54O2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C31H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-31(32)33-29-28-30-25-22-21-23-26-30/h21-23,25-26H,2-20,24,27-29H2,1H3
InChIKey URXXFQRMWBGDRI-UHFFFAOYSA-N
Molecular Weight 458.771 g/mol
Nominal Mass 458 u
Number of Peaks 222
SMILES C(CCCCCCCCCCCCCCCCCCCCCC)(=O)OCCc1ccccc1
SPLASH splash10-0udi-3900000000-0bd16a8633846626885d
Source Populus nigra, SFE extract
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI001763