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tert-butyl [2-(1-hydroxy-2-nitro-octyl)-2,5,7,8-tetramethyl-chroman-6-yl] carbonate
SpectraBase Compound ID Jy3dhH0AIcw
InChI InChI=1S/C26H41NO7/c1-9-10-11-12-13-20(27(30)31)23(28)26(8)15-14-19-18(4)21(16(2)17(3)22(19)33-26)32-24(29)34-25(5,6)7/h20,23,28H,9-15H2,1-8H3
InChIKey URSFKRVXSZQZCE-UHFFFAOYSA-N
Mol Weight 479.6 g/mol
Molecular Formula C26H41NO7
Exact Mass 479.288303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1isMDuwoi0
Name tert-butyl [2-(1-hydroxy-2-nitro-octyl)-2,5,7,8-tetramethyl-chroman-6-yl] carbonate
Appearance Yellow oil
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Formula C26H41NO7
InChI InChI=1S/C26H41NO7/c1-9-10-11-12-13-20(27(30)31)23(28)26(8)15-14-19-18(4)21(16(2)17(3)22(19)33-26)32-24(29)34-25(5,6)7/h20,23,28H,9-15H2,1-8H3
InChIKey URSFKRVXSZQZCE-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 479.614 g/mol
Reported Formula C26H41NO7
SMILES OC(C1(CCc2c(c(OC(=O)OC(C)(C)C)c(c(c2O1)C)C)C)C)C(CCCCCC)[N+](=O)[O-]
SPLASH splash10-0a4i-6091000000-339ccd0c93a214036e5b
Sample Comments diasteromeric mixture
Source of Spectrum US20180057475A1
Wiley ID 1870641