diethyl 2,2-bis{[(5-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]sulfanyl}-1-cyanovinylphosphonate

SpectraBase Compound ID	4jFG7ykJQR3
InChI	InChI=1S/C23H20Cl2N3O7PS2/c1-3-32-36(31,33-4-2)20(11-26)21(37-12-27-16-9-14(24)5-7-18(16)34-22(27)29)38-13-28-17-10-15(25)6-8-19(17)35-23(28)30/h5-10H,3-4,12-13H2,1-2H3
InChIKey	DQWBQQOIHJBNPO-UHFFFAOYSA-N Google Search
Mol Weight	616.43 g/mol
Molecular Formula	C23H20Cl2N3O7PS2
Exact Mass	614.985735 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	Jviv5Id77tT
Name	diethyl 2,2-bis{[(5-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]sulfanyl}-1-cyanovinylphosphonate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C23H20Cl2N3O7PS2/c1-3-32-36(31,33-4-2)20(11-26)21(37-12-27-16-9-14(24)5-7-18(16)34-22(27)29)38-13-28-17-10-15(25)6-8-19(17)35-23(28)30/h5-10H,3-4,12-13H2,1-2H3
InChIKey	DQWBQQOIHJBNPO-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_12934
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: S16138; Labnumber: TTT-0489; VK_ID: VK-012939
Temperature	308 °C