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N-Carbobenzoxy sphinganine

View entire compound with spectra: 1 MS (GC)

N-Carbobenzoxy sphinganine
SpectraBase Compound ID 2OiB81a18Yj
InChI InChI=1S/C26H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(29)24(21-28)27-26(30)31-22-23-18-15-14-16-19-23/h14-16,18-19,24-25,28-29H,2-13,17,20-22H2,1H3,(H,27,30)/t24-,25+/m0/s1
InChIKey CPOVNSASEYRGDG-LOSJGSFVSA-N
Mol Weight 435.6 g/mol
Molecular Formula C26H45NO4
Exact Mass 435.334859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRrbsxa6UDd
Name N-Carbobenzoxy sphinganine
Alternate Name(s) benzyl (1S,2R)-2-hydroxy-1-(hydroxymethyl)heptadecylcarbamate
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Formula C26H45NO4
InChI InChI=1S/C26H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(29)24(21-28)27-26(30)31-22-23-18-15-14-16-19-23/h14-16,18-19,24-25,28-29H,2-13,17,20-22H2,1H3,(H,27,30)/t24-,25+/m0/s1
InChIKey CPOVNSASEYRGDG-LOSJGSFVSA-N
Molecular Weight 435.649 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](CO)([C@](O)(CCCCCCCCCCCCCCC)[H])[H]
SPLASH splash10-0006-9200000000-26ed158fe1aa6473f88e
Source of Spectrum SW-0-219-0
Wiley ID 1383282