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2-(Phenylmethyl)-4H-1,4-benzothiazin-3-one
SpectraBase Compound ID JvAen3yMhs6
InChI InChI=1S/C15H13NOS/c17-15-14(10-11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-9,14H,10H2,(H,16,17)
InChIKey GPHJQBBJVYELEE-UHFFFAOYSA-N
Mol Weight 255.33 g/mol
Molecular Formula C15H13NOS
Exact Mass 255.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqfvioFEpig
Name 2-(Phenylmethyl)-4H-1,4-benzothiazin-3-one
CAS Registry Number 104505-74-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NOS
InChI InChI=1S/C15H13NOS/c17-15-14(10-11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-9,14H,10H2,(H,16,17)
InChIKey GPHJQBBJVYELEE-UHFFFAOYSA-N
Molecular Weight 255.335 g/mol
SMILES N1c2c(SC(C1=O)Cc1ccccc1)cccc2
SPLASH splash10-06si-0920000000-bbb07aa09e46eadc3e4c
Source of Spectrum K-119-3118-18
Synonyms 2-Benzyl-4H-1,4-benzothiazin-3-one
Wiley ID 1258853