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Ethyl 3-allyl-8-benzamido-3,4-dihydro-2H-thieno[3,2-h][1,3]benzoxazine-7-carboxylate
SpectraBase Compound ID 5FzNEBRBvhR
InChI InChI=1S/C23H22N2O4S/c1-3-12-25-13-16-10-11-17-18(23(27)28-4-2)22(30-20(17)19(16)29-14-25)24-21(26)15-8-6-5-7-9-15/h3,5-11H,1,4,12-14H2,2H3,(H,24,26)
InChIKey JFRJTJQNRGMBKA-UHFFFAOYSA-N
Mol Weight 422.5 g/mol
Molecular Formula C23H22N2O4S
Exact Mass 422.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YdTCQgoKIE
Name ETHYL 3-ALLYL-8-BENZAMIDO-3,4-DIHYDRO-2H-THIENO[3,2-H][1,3]BENZOXAZINE-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H22N2O4S
InChI InChI=1S/C23H22N2O4S/c1-3-12-25-13-16-10-11-17-18(23(27)28-4-2)22(30-20(17)19(16)29-14-25)24-21(26)15-8-6-5-7-9-15/h3,5-11H,1,4,12-14H2,2H3,(H,24,26)
InChIKey JFRJTJQNRGMBKA-UHFFFAOYSA-N
Molecular Weight 422.1295
SMILES N(C(c1ccccc1)=O)c1sc2c(c1C(OCC)=O)ccc1CN(CC=C)COc21
SPLASH splash10-0a6r-9700000000-87e44a465748dc824b40
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany