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1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-, 1-oxide
SpectraBase Compound ID kRYnFA9eWB
InChI InChI=1S/C9H9NO2S/c11-9-5-6-13(12)8-4-2-1-3-7(8)10-9/h1-4H,5-6H2,(H,10,11)
InChIKey RVGVNLVZTYJHIS-UHFFFAOYSA-N
Mol Weight 195.24 g/mol
Molecular Formula C9H9NO2S
Exact Mass 195.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LyHliKKFTQ
Name 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-, 1-oxide
CAS Registry Number 55848-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO2S
InChI InChI=1S/C9H9NO2S/c11-9-5-6-13(12)8-4-2-1-3-7(8)10-9/h1-4H,5-6H2,(H,10,11)
InChIKey RVGVNLVZTYJHIS-UHFFFAOYSA-N
Molecular Weight 195.236 g/mol
SMILES N1C(CCS(c2c1cccc2)=O)=O
SPLASH splash10-0002-0900000000-af0bee6f4c3412b4fd40
Source of Spectrum I-53-280-0
Synonyms 1-Oxo-3,5-dihydro-2H-1$l^{4},5-benzothiazepin-4-one 1-Oxidanylidene-3,5-dihydro-2H-1$l^{4},5-benzothiazepin-4-one
Wiley ID 1191818