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CnVRmSTcY2n
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CnVRmSTcY2n
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3H-Naphtho[1,2-e][1,2]thiazin-2(4aH)-one, 5,6-dihydro-8,9-dimethoxy-3-(phenylmethyl)-, 4,4-dioxide
SpectraBase Compound ID BCGJb1ewFJy
InChI InChI=1S/C21H21NO5S/c1-26-18-10-15-8-9-20-17(16(15)11-19(18)27-2)12-21(23)22(28(20,24)25)13-14-6-4-3-5-7-14/h3-7,10-12,20H,8-9,13H2,1-2H3
InChIKey RIJXBFFBAPQJJA-UHFFFAOYSA-N
Mol Weight 399.46 g/mol
Molecular Formula C21H21NO5S
Exact Mass 399.114044 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnVRmSTcY2n
Name 3H-Naphtho[1,2-e][1,2]thiazin-2(4aH)-one, 5,6-dihydro-8,9-dimethoxy-3-(phenylmethyl)-, 4,4-dioxide
CAS Registry Number 40535-18-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO5S
InChI InChI=1S/C21H21NO5S/c1-26-18-10-15-8-9-20-17(16(15)11-19(18)27-2)12-21(23)22(28(20,24)25)13-14-6-4-3-5-7-14/h3-7,10-12,20H,8-9,13H2,1-2H3
InChIKey RIJXBFFBAPQJJA-UHFFFAOYSA-N
Molecular Weight 399.461 g/mol
SMILES COc1cc2CCC3C(=CC(N(Cc4ccccc4)S3(=O)=O)=O)c2cc1OC
SPLASH splash10-001v-6596000000-a939b48680fd97991300
Source of Spectrum EP-6108-0-0
Synonyms 3-Benzyl-8,9-dimethoxy-5,6-dihydro-3H-naphtho[1,2-E][1,2]thiazin-2(4ah)-one 4,4-dioxide 3-Benzyl-4,4-diketo-8,9-dimethoxy-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one 3-Benzyl-8,9-dimethoxy-4,4-dioxo-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one 8,9-Dimethoxy-4,4-bis(oxidanylidene)-3-(phenylmethyl)-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one 8,9-Dimethoxy-4,4-dioxo-3-(phenylmethyl)-5,6-dihydro-4aH-benzo[f][1,2]benzothiazin-2-one
Wiley ID 1368939
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