SpectraBase Spectrum ID |
5UbScq54Mhz |
Name |
Cer 8:0;2O/16:2 |
Classification |
Sphingolipids [SP] |
Comments |
Ceramide non-hydroxyfatty acid-dihydrosphingosine |
Copyright |
Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
395.339944310 u |
Formula |
C24H45NO3 |
InChI |
InChI=1S/C24H45NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-20-24(28)25-22(21-26)23(27)19-17-6-4-2/h7-8,10-11,22-23,26-27H,3-6,9,12-21H2,1-2H3,(H,25,28)/b8-7-,11-10- |
InChIKey |
AJXRMUSOWYZWDP-NQLNTKRDNA-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 |
CCCCCC(O)C(CO)NC(=O)CCCCCCC\C=C/C\C=C/CCC |
Sample Comments |
theoretical MS2 created from the information of SCIEX 5600 and 6600 with 45CE +-15CES |