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18-Hydroxypentacos-21-en-1-oic acid

View entire compound with spectra: 1 MS (GC)

18-Hydroxypentacos-21-en-1-oic acid
SpectraBase Compound ID BH3Xyadb2iO
InChI InChI=1S/C25H48O3/c1-2-3-4-15-18-21-24(26)22-19-16-13-11-9-7-5-6-8-10-12-14-17-20-23-25(27)28/h4,15,24,26H,2-3,5-14,16-23H2,1H3,(H,27,28)/b15-4+
InChIKey OLSPLPNHYLLHGF-SYZQJQIISA-N
Mol Weight 396.7 g/mol
Molecular Formula C25H48O3
Exact Mass 396.360345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WQPayk3PG2
Name 18-Hydroxypentacos-21-en-1-oic acid
Alternate Name(s) (21E)-18-hydroxy-21-pentacosenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H48O3
InChI InChI=1S/C25H48O3/c1-2-3-4-15-18-21-24(26)22-19-16-13-11-9-7-5-6-8-10-12-14-17-20-23-25(27)28/h4,15,24,26H,2-3,5-14,16-23H2,1H3,(H,27,28)/b15-4+
InChIKey OLSPLPNHYLLHGF-SYZQJQIISA-N
Molecular Weight 396.656 g/mol
SMILES OC(CCCCCCCCCCCCCCCCC(=O)O)CC\C=C\CCC
SPLASH splash10-00l7-9001000000-b703c95a590946c9d919
Source of Spectrum Y1-38-707-4
Wiley ID 1527738