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1,3-Bis[N-neo-pentyl-N-(phenoxycarbonyl)aminocarbonyl]-1,3-diazetidin-2,4-dione
SpectraBase Compound ID JIe2l8fyzGE
InChI InChI=1S/C28H32N4O8/c1-27(2,3)17-29(25(37)39-19-13-9-7-10-14-19)21(33)31-23(35)32(24(31)36)22(34)30(18-28(4,5)6)26(38)40-20-15-11-8-12-16-20/h7-16H,17-18H2,1-6H3
InChIKey BOGIEZXKLFWFBF-UHFFFAOYSA-N
Mol Weight 552.6 g/mol
Molecular Formula C28H32N4O8
Exact Mass 552.222014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C654BeyCx5G
Name 1,3-Bis[N-neo-pentyl-N-(phenoxycarbonyl)aminocarbonyl]-1,3-diazetidin-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32N4O8
InChI InChI=1S/C28H32N4O8/c1-27(2,3)17-29(25(37)39-19-13-9-7-10-14-19)21(33)31-23(35)32(24(31)36)22(34)30(18-28(4,5)6)26(38)40-20-15-11-8-12-16-20/h7-16H,17-18H2,1-6H3
InChIKey BOGIEZXKLFWFBF-UHFFFAOYSA-N
Molecular Weight 552.584 g/mol
SMILES C1(N(C(N1C(N(C(Oc1ccccc1)=O)CC(C)(C)C)=O)=O)C(N(C(Oc1ccccc1)=O)CC(C)(C)C)=O)=O
SPLASH splash10-00dl-9100000000-1f21538fc3bcdc525dbc
Source of Spectrum SO-0-951-7
Synonyms phenyl neopentyl[(3-{[neopentyl(phenoxycarbonyl)amino]carbonyl}-2,4-dioxo-1,3-diazetidin-1-yl)carbonyl]carbamate
Wiley ID 1537784