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4-(5,5-Dimethyl-1,3-dioxan-2-yl)phenyl-N,N-diisopropylcarbamate
SpectraBase Compound ID 9Gs9nRnDIqZ
InChI InChI=1S/C19H29NO4/c1-13(2)20(14(3)4)18(21)24-16-9-7-15(8-10-16)17-22-11-19(5,6)12-23-17/h7-10,13-14,17H,11-12H2,1-6H3
InChIKey URWTVPSQDUGIIM-UHFFFAOYSA-N
Mol Weight 335.44 g/mol
Molecular Formula C19H29NO4
Exact Mass 335.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsQcfLZjfi1
Name 4-(5,5-Dimethyl-1,3-dioxan-2-yl)phenyl-N,N-diisopropylcarbamate
Appearance White solid
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Exact Mass 335.209658414 u
Formula C19H29NO4
InChI InChI=1S/C19H29NO4/c1-13(2)20(14(3)4)18(21)24-16-9-7-15(8-10-16)17-22-11-19(5,6)12-23-17/h7-10,13-14,17H,11-12H2,1-6H3
InChIKey URWTVPSQDUGIIM-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000 or HP 5890-5989B
Ionization Type EI
Literature Reference DOI 10.1002/chem.202201154
Molecular Weight 335.444 g/mol
Quality 129
Reported Formula C19H29NO4
SMILES C1=CC(=CC=C1OC(N(C(C)C)C(C)C)=O)C1OCC(CO1)(C)C
SPLASH splash10-004r-9810000000-cabd46e5b0badd1862bb
Source of Spectrum QE-28-SM4-2q (DOI: 10.1002/chem.202201154)
Thin-Layer Chromatography 0.35 (petroleum ether/Et2O (7:3) + 0.5% Et3N)
Wiley ID 1900502