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2H-Thiepino[2,3-b]indol-4-ol, 3,4,5,10-tetrahydro-, acetate (ester)
SpectraBase Compound ID 1NxMim83gM3
InChI InChI=1S/C14H15NO2S/c1-9(16)17-10-6-7-18-14-12(8-10)11-4-2-3-5-13(11)15-14/h2-5,10,15H,6-8H2,1H3
InChIKey OEIWOHVZINIAII-UHFFFAOYSA-N
Mol Weight 261.34 g/mol
Molecular Formula C14H15NO2S
Exact Mass 261.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HStN1I3kNdh
Name 2H-Thiepino[2,3-b]indol-4-ol, 3,4,5,10-tetrahydro-, acetate (ester)
Alternate Name(s) 1-Thia-5-acetoxycycloheplto[2,3-b]indole 3,4,5,10-tetrahydro-2H-thiepino[2,3-b]indol-4-yl acetate
CAS Registry Number 129627-51-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO2S
InChI InChI=1S/C14H15NO2S/c1-9(16)17-10-6-7-18-14-12(8-10)11-4-2-3-5-13(11)15-14/h2-5,10,15H,6-8H2,1H3
InChIKey OEIWOHVZINIAII-UHFFFAOYSA-N
Molecular Weight 261.339 g/mol
SMILES [nH]1c2ccccc2c2c1SCCC(C2)OC(=O)C
SPLASH splash10-0h90-0790000000-20eaf679012a39c93b58
Source of Spectrum KC-1990-822-17
Wiley ID 1264691