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1'-METHYLSPIRO-[4H-3,1-BENZOXATHIIN-2,3'-[3H]-INDOL]-2'(1'H)-ONE
SpectraBase Compound ID EYZzmXtxjX3
InChI InChI=1S/C16H13NO2S/c1-17-13-8-4-3-7-12(13)16(15(17)18)19-10-11-6-2-5-9-14(11)20-16/h2-9H,10H2,1H3
InChIKey ZSSDODKLHDRYEU-UHFFFAOYSA-N
Mol Weight 283.35 g/mol
Molecular Formula C16H13NO2S
Exact Mass 283.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6hjXFg171r
Name 1-Methylspiro[4H-3,1-benzoxathiin-2,3'(3H)-indol]-2'(1'H)-one
CAS Registry Number 124921-60-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO2S
InChI InChI=1S/C16H13NO2S/c1-17-13-8-4-3-7-12(13)16(15(17)18)19-10-11-6-2-5-9-14(11)20-16/h2-9H,10H2,1H3
InChIKey ZSSDODKLHDRYEU-UHFFFAOYSA-N
Molecular Weight 283.345 g/mol
SMILES C12(C(N(C)c3c2cccc3)=O)Sc2ccccc2CO1
SPLASH splash10-00di-0900000000-359df6079c730cf8da48
Source of Spectrum K-123-1146-4
Synonyms 1'-methyl-1',2'-dihydro-4H-spiro[3,1-benzoxathiine-2,3'-indole]-2'-one
Wiley ID 1286939