For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-Bis[3-(3,3-diisopropylureido)-4-methylphenyl]-[1,3]diazetidin-2,4-dione
SpectraBase Compound ID DaInSQa1BsC
InChI InChI=1S/C30H42N6O4/c1-17(2)33(18(3)4)27(37)31-25-15-23(13-11-21(25)9)35-29(39)36(30(35)40)24-14-12-22(10)26(16-24)32-28(38)34(19(5)6)20(7)8/h11-20H,1-10H3,(H,31,37)(H,32,38)
InChIKey OMNMRIFDLVTKBI-UHFFFAOYSA-N
Mol Weight 550.7 g/mol
Molecular Formula C30H42N6O4
Exact Mass 550.326754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID A5ILUB3zWZd
Name 1,3-Bis[3-(3,3-diisopropylureido)-4-methylphenyl]-[1,3]diazetidin-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42N6O4
InChI InChI=1S/C30H42N6O4/c1-17(2)33(18(3)4)27(37)31-25-15-23(13-11-21(25)9)35-29(39)36(30(35)40)24-14-12-22(10)26(16-24)32-28(38)34(19(5)6)20(7)8/h11-20H,1-10H3,(H,31,37)(H,32,38)
InChIKey OMNMRIFDLVTKBI-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(199910)341_7_616
Molecular Weight 550.704 g/mol
SMILES N(c1c(ccc(N2C(N(c3ccc(c(NC(N(C(C)C)C(C)C)=O)c3)C)C2=O)=O)c1)C)C(N(C(C)C)C(C)C)=O
SPLASH splash10-002o-9200000000-eb5f09169b245ede819a
Source of Spectrum JF-341-618-7a
Synonyms 1,1'-((2,4-dioxo-1,3-diazetidine-1,3-diyl)bis(2-methyl-5,1-phenylene))bis(3,3-diisopropylurea)
Wiley ID 1766755