For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Cer 11:0;3O/12:1;(2OH)
SpectraBase Compound ID CR8ROJgURX8
InChI InChI=1S/C23H45NO5/c1-3-5-7-9-10-11-13-15-17-21(27)23(29)24-19(18-25)22(28)20(26)16-14-12-8-6-4-2/h11,13,19-22,25-28H,3-10,12,14-18H2,1-2H3,(H,24,29)/b13-11-
InChIKey XOUSZJLBCQRAHP-QBFSEMIENA-N
Mol Weight 415.6 g/mol
Molecular Formula C23H45NO5
Exact Mass 415.329774 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7WIbqVDjREp
Name Cer 11:0;3O/12:1;(2OH)
Classification Sphingolipids [SP]
Comments Ceramide alpha-hydroxy fatty acid-phytospingosine
Copyright Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.329773548 u
Formula C23H45NO5
InChI InChI=1S/C23H45NO5/c1-3-5-7-9-10-11-13-15-17-21(27)23(29)24-19(18-25)22(28)20(26)16-14-12-8-6-4-2/h11,13,19-22,25-28H,3-10,12,14-18H2,1-2H3,(H,24,29)/b13-11-
InChIKey XOUSZJLBCQRAHP-QBFSEMIENA-N
Ion Polarity N
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 CCCCCCCC(O)C(O)C(CO)NC(=O)C(O)CC\C=C/CCCCCC
Sample Comments theoretical MS2 created from the information of SCIEX 5600 and 6600 with 45CE +-15CES