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2-(tert-Butylamino)-1-(2-(triphenylphosphoranylidene) aminophenyl)-2-oxoethyl 4-nitrobenzoate
SpectraBase Compound ID DDUH9Z7bYJZ
InChI InChI=1S/C37H34N3O5P/c1-37(2,3)38-35(41)34(45-36(42)27-23-25-28(26-24-27)40(43)44)32-21-13-14-22-33(32)39-46(29-15-7-4-8-16-29,30-17-9-5-10-18-30)31-19-11-6-12-20-31/h4-26,34H,1-3H3,(H,38,41)
InChIKey PXWRHIKUTYCXHP-UHFFFAOYSA-N
Mol Weight 631.7 g/mol
Molecular Formula C37H34N3O5P
Exact Mass 631.223608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kt9S391BdZD
Name 2-(tert-Butylamino)-1-(2-(triphenylphosphoranylidene) aminophenyl)-2-oxoethyl 4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H34N3O5P
InChI InChI=1S/C37H34N3O5P/c1-37(2,3)38-35(41)34(45-36(42)27-23-25-28(26-24-27)40(43)44)32-21-13-14-22-33(32)39-46(29-15-7-4-8-16-29,30-17-9-5-10-18-30)31-19-11-6-12-20-31/h4-26,34H,1-3H3,(H,38,41)
InChIKey PXWRHIKUTYCXHP-UHFFFAOYSA-N
Molecular Weight 631.669 g/mol
SMILES N(C(C(c1c(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)cccc1)OC(c1ccc(N(=O)=O)cc1)=O)=O)C(C)(C)C
SPLASH splash10-001i-0393703000-6d38a967d0331d695c61
Source of Spectrum F-65-8566-2h
Wiley ID 1679367