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Cer(d14:1/18:0)+HCO2
SpectraBase Compound ID AaI3rDhCM63
InChI InChI=1S/C32H63NO3/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-32(36)33-30(29-34)31(35)27-25-23-21-19-12-10-8-6-4-2/h25,27,30-31,34-35H,3-24,26,28-29H2,1-2H3,(H,33,36)/b27-25+/t30-,31+/m0/s1
InChIKey NCKNBDIYAHEWMH-JHRQRACZSA-N
Mol Weight 509.9 g/mol
Molecular Formula C32H63NO3
Exact Mass 509.480795 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9cAhdEVzcNK
Name Cer(d14:1/18:0)+H
Classification Sphingolipids [SP]
Comments Ceramide
Copyright Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 509.480794890 u
Formula C32H63NO3
InChI InChI=1S/C32H63NO3/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-32(36)33-30(29-34)31(35)27-25-23-21-19-12-10-8-6-4-2/h25,27,30-31,34-35H,3-24,26,28-29H2,1-2H3,(H,33,36)/b27-25+/t30-,31+/m0/s1
InChIKey NCKNBDIYAHEWMH-JHRQRACZSA-N
Ion Polarity P
Literature Reference Koelmel, J. P.; Kroeger, N. M.; Ulmer, C. Z.; Bowden, J. A.; Patterson, R. E.; Cochran, J. A.; Beecher, C. W. W.; Garrett, T. J.; Yost, R. A. LipidMatch: An Automated Workflow for Rule-Based Lipid Identification Using Untargeted High-Resolution Tandem Mass Spectrometry Data. BMC Bioinformatics 2017, 18 (1).
Literature Reference DOI 10.1186/s12859-017-1744-3
Precursor Ion [M+H]+
SMILES O[C@@]([C@](CO)(NC(=O)CCCCCCCCCCCCCCCCC)[H])(\C=C\CCCCCCCCC)[H]
Sample Comments LM ID: LMSP02010034
Synonyms N-(octadecanoyl)-tetradecasphing-4-enine Cer(d14:1(4E)/18:0) Cer[NS]