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5,6-Dihydro-8H,13aH-pyrrolo[2',1':3,4]pyrazino[2,1-b][1,3]-benzothiazine-8-one
SpectraBase Compound ID L5XkPJ874vD
InChI InChI=1S/C14H12N2OS/c17-13-10-4-1-2-6-12(10)18-14-11-5-3-7-15(11)8-9-16(13)14/h1-7,14H,8-9H2
InChIKey VFGUWASHSPMJHK-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C14H12N2OS
Exact Mass 256.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgOwo3UmJ4s
Name 5,6-Dihydro-8H,13aH-pyrrolo[2',1':3,4]pyrazino[2,1-b][1,3]-benzothiazine-8-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.067034187 u
Formula C14H12N2OS
InChI InChI=1S/C14H12N2OS/c17-13-10-4-1-2-6-12(10)18-14-11-5-3-7-15(11)8-9-16(13)14/h1-7,14H,8-9H2
InChIKey VFGUWASHSPMJHK-UHFFFAOYSA-N
Instrument Name Finnigan MAT INCOS 50
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900142
Quality 75
SMILES C=1C=CN2C1C1SC3=C(C(N1CC2)=O)C=CC=C3
SPLASH splash10-00dr-0900000000-faf3a1cb12dee8b618df
Source of Spectrum K1-2019-4156-9a (DOI: 10.1002/ejoc.201900142)
Thin-Layer Chromatography 0.12 (CH2Cl2)
Wiley ID 1894482