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Pimelic acid, 4-heptyl hexadecyl ester
SpectraBase Compound ID J5LmYRT3U7
InChI InChI=1S/C30H58O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-22-27-33-29(31)25-20-19-21-26-30(32)34-28(23-5-2)24-6-3/h28H,4-27H2,1-3H3
InChIKey WAEPZFPNCJWDLM-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 LID2JW2xGiO
Name Pimelic acid, 4-heptyl hexadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H58O4
InChI InChI=1S/C30H58O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-22-27-33-29(31)25-20-19-21-26-30(32)34-28(23-5-2)24-6-3/h28H,4-27H2,1-3H3
InChIKey WAEPZFPNCJWDLM-UHFFFAOYSA-N
Molecular Weight 482.790 g/mol
SMILES C(CCCCCC(OC(CCC)CCC)=O)(OCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-7900000000-126395284a433131289e
Source of Spectrum TIPS-2022-832-0
Wiley ID 1822349