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2,3-Dihydroxy-3,7,11,15-tetramethylhexadecan-1-ol nitrate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,3-Dihydroxy-3,7,11,15-tetramethylhexadecan-1-ol nitrate
SpectraBase Compound ID 2dlmIkwTzZl
InChI InChI=1S/C20H41NO5/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-20(5,23)19(22)15-26-21(24)25/h16-19,22-23H,6-15H2,1-5H3
InChIKey JTBGMTKEKZFXJG-UHFFFAOYSA-N
Mol Weight 375.6 g/mol
Molecular Formula C20H41NO5
Exact Mass 375.298473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KTIPo2dooFe
Name 2,3-Dihydroxy-3,7,11,15-tetramethylhexadecan-1-ol nitrate
Comments Computed using HOSE algorithm
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Exact Mass 375.298473419 u
Formula C20H41NO5
InChI InChI=1S/C20H41NO5/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-20(5,23)19(22)15-26-21(24)25/h16-19,22-23H,6-15H2,1-5H3
InChIKey JTBGMTKEKZFXJG-UHFFFAOYSA-N
Molecular Weight 375.550 g/mol
SMILES C(C(C(CCCC(CCCC(CCCC(C)C)C)C)(C)O)O)ON(=O)=O