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2-(3-Nitrophenoxy)-3-phenylbenzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID LWbIizu6Hi5
InChI InChI=1S/C22H13N3O4S/c26-21-20-19(17-11-4-5-12-18(17)30-20)23-22(24(21)14-7-2-1-3-8-14)29-16-10-6-9-15(13-16)25(27)28/h1-13H
InChIKey ZETBKBFZUHXTCW-UHFFFAOYSA-N
Mol Weight 415.42 g/mol
Molecular Formula C22H13N3O4S
Exact Mass 415.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cMckVptUMX
Name 2-(3-Nitrophenoxy)-3-phenylbenzothieno[3,2-d]pyrimidin-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H13N3O4S
InChI InChI=1S/C22H13N3O4S/c26-21-20-19(17-11-4-5-12-18(17)30-20)23-22(24(21)14-7-2-1-3-8-14)29-16-10-6-9-15(13-16)25(27)28/h1-13H
InChIKey ZETBKBFZUHXTCW-UHFFFAOYSA-N
Molecular Weight 415.423 g/mol
SMILES c12c(N=C(N(C2=O)c2ccccc2)Oc2cc(N(=O)=O)ccc2)c2ccccc2s1
SPLASH splash10-004i-9310000000-d4029bceacbd1dc9d133
Source of Spectrum F4-0-4184-6
Synonyms 2-(3-nitrophenoxy)-3-phenyl[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Wiley ID 1621145