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Cer 34:0;2O/8:0
SpectraBase Compound ID IYFTKurFKkv
InChI InChI=1S/C42H85NO3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-34-35-37-41(45)40(39-44)43-42(46)38-36-33-8-6-4-2/h40-41,44-45H,3-39H2,1-2H3,(H,43,46)
InChIKey GVJJARGDZXOURQ-UHFFFAOYNA-N
Mol Weight 652.1 g/mol
Molecular Formula C42H85NO3
Exact Mass 651.652946 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID FIqCNFXKTC8
Name Cer 34:0;2O/8:0
Classification Sphingolipids [SP]
Comments Ceramide non-hydroxyfatty acid-dihydrosphingosine
Copyright Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 651.652945598 u
Formula C42H85NO3
InChI InChI=1S/C42H85NO3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-34-35-37-41(45)40(39-44)43-42(46)38-36-33-8-6-4-2/h40-41,44-45H,3-39H2,1-2H3,(H,43,46)
InChIKey GVJJARGDZXOURQ-UHFFFAOYNA-N
Ion Polarity P
Literature Reference Tsugawa, H.; Ikeda, K.; Takahashi, M.; Satoh, A.; Mori, Y.; Uchino, H.; Okahashi, N.; Yamada, Y.; Tada, I.; Bonini, P.; Higashi, Y.; Okazaki, Y.; Zhou, Z.; Zhu, Z.-J.; Koelmel, J.; Cajka, T.; Fiehn, O.; Saito, K.; Arita, M.; Arita, M. A Lipidome Atlas in MS-DIAL 4. Nature Biotechnology 2020, 38 (10), 1159–1163.
Literature Reference DOI https://doi.org/10.1038/s41587-020-0531-2
Precursor Ion [M+H]+
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(CO)NC(=O)CCCCCCC
Sample Comments theoretical MS2 created from the information of SCIEX 5600 and 6600 with 45CE +-15CES