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1-Formylpyrrolo[2,1-b][1,3]benzothiazin-9-one
SpectraBase Compound ID LKtqNxmwdie
InChI InChI=1S/C12H7NO2S/c14-7-8-5-6-11-13(8)12(15)9-3-1-2-4-10(9)16-11/h1-7H
InChIKey YXAVZRFZXVHSOS-UHFFFAOYSA-N
Mol Weight 229.25 g/mol
Molecular Formula C12H7NO2S
Exact Mass 229.01975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmNeiR7AaI3
Name 1-Formylpyrrolo[2,1-b][1,3]benzothiazin-9-one
Alternate Name(s) 9-Oxo-9H-pyrrolo[2,1-b][1,3]benzothiazine-1-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7NO2S
InChI InChI=1S/C12H7NO2S/c14-7-8-5-6-11-13(8)12(15)9-3-1-2-4-10(9)16-11/h1-7H
InChIKey YXAVZRFZXVHSOS-UHFFFAOYSA-N
Molecular Weight 229.253 g/mol
SMILES c12[n](C(c3c(S2)cccc3)=O)c(cc1)C=O
SPLASH splash10-004i-0290000000-a61588f34d3763bbb7a9
Source of Spectrum J-57-3680-6
Wiley ID 1230660