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Pimelic acid, hept-2-yl hexadecyl ester
SpectraBase Compound ID 33daHAGBGl2
InChI InChI=1S/C30H58O4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-23-27-33-29(31)25-21-19-22-26-30(32)34-28(3)24-20-7-5-2/h28H,4-27H2,1-3H3
InChIKey ZAWFHKROICIHSJ-UHFFFAOYSA-N
Mol Weight 482.8 g/mol
Molecular Formula C30H58O4
Exact Mass 482.43351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYf2f7GVUNI
Name Pimelic acid, hept-2-yl hexadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H58O4
InChI InChI=1S/C30H58O4/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-23-27-33-29(31)25-21-19-22-26-30(32)34-28(3)24-20-7-5-2/h28H,4-27H2,1-3H3
InChIKey ZAWFHKROICIHSJ-UHFFFAOYSA-N
Molecular Weight 482.790 g/mol
SMILES C(CCCCCC(OC(CCCCC)C)=O)(OCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-7900000000-deb1ae8def8bf764d45b
Source of Spectrum TIPS-2022-991-0
Wiley ID 1822508