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6-Benzoyloctylamino-4-octyl-2H-1,4-benzothiazin-3-one
SpectraBase Compound ID 9JH8OHXLAIA
InChI InChI=1S/C31H44N2O2S/c1-3-5-7-9-11-16-22-32(31(35)26-18-14-13-15-19-26)27-20-21-29-28(24-27)33(30(34)25-36-29)23-17-12-10-8-6-4-2/h13-15,18-21,24H,3-12,16-17,22-23,25H2,1-2H3
InChIKey MLVKQOZOUWYULF-UHFFFAOYSA-N
Mol Weight 508.8 g/mol
Molecular Formula C31H44N2O2S
Exact Mass 508.31235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jVuqROQa07
Name 6-Benzoyloctylamino-4-octyl-2H-1,4-benzothiazin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H44N2O2S
InChI InChI=1S/C31H44N2O2S/c1-3-5-7-9-11-16-22-32(31(35)26-18-14-13-15-19-26)27-20-21-29-28(24-27)33(30(34)25-36-29)23-17-12-10-8-6-4-2/h13-15,18-21,24H,3-12,16-17,22-23,25H2,1-2H3
InChIKey MLVKQOZOUWYULF-UHFFFAOYSA-N
Molecular Weight 508.765 g/mol
SMILES c12N(C(CSc1ccc(c2)N(C(=O)c1ccccc1)CCCCCCCC)=O)CCCCCCCC
SPLASH splash10-0a4i-2900030000-63a7e56a771f304d24e2
Source of Spectrum EMC-38-773-9b
Synonyms N-octyl-N-(4-octyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazin-6-yl)benzamide N-octyl-N-(4-octyl-3-oxo-1,4-benzothiazin-6-yl)benzamide N-octyl-N-(4-octyl-3-oxidanylidene-1,4-benzothiazin-6-yl)benzamide
Wiley ID 1734712