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3,3'-(1,4-Phenylene)bis(2-thioxo-2,3-dihydrobenzo[e][1,3]oxazine-4-one)
SpectraBase Compound ID J9h5BFqR81B
InChI InChI=1S/C22H12N2O4S2/c25-19-15-5-1-3-7-17(15)27-21(29)23(19)13-9-11-14(12-10-13)24-20(26)16-6-2-4-8-18(16)28-22(24)30/h1-12H
InChIKey NIRBKKBSOGJBCT-UHFFFAOYSA-N
Mol Weight 432.47 g/mol
Molecular Formula C22H12N2O4S2
Exact Mass 432.023849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EQO2NSMzxs
Name 3,3'-(1,4-Phenylene)bis(2-thioxo-2,3-dihydrobenzo[e][1,3]oxazine-4-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H12N2O4S2
InChI InChI=1S/C22H12N2O4S2/c25-19-15-5-1-3-7-17(15)27-21(29)23(19)13-9-11-14(12-10-13)24-20(26)16-6-2-4-8-18(16)28-22(24)30/h1-12H
InChIKey NIRBKKBSOGJBCT-UHFFFAOYSA-N
Molecular Weight 432.468 g/mol
SMILES C1(N(C(c2c(O1)cccc2)=O)c1ccc(N2C(Oc3c(C2=O)cccc3)=S)cc1)=S
SPLASH splash10-001a-4915100000-84bb478fa438797c0b99
Source of Spectrum CV-0-166-15
Synonyms 3-[4-(4-oxo-2-thioxo-2H-1,3-benzoxazin-3(4H)-yl)phenyl]-2-thioxo-2,3-dihydro-4H-1,3-benzoxazin-4-one
Wiley ID 872754