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2-Oxa-3-azabicyclo[3.2.1]oct-6-ene, 3-[(4-methylphenyl)sulfonyl]-
SpectraBase Compound ID 8FxHBcX89bX
InChI InChI=1S/C13H15NO3S/c1-10-2-6-13(7-3-10)18(15,16)14-9-11-4-5-12(8-11)17-14/h2-7,11-12H,8-9H2,1H3
InChIKey QZFYJRRAJZSTJM-UHFFFAOYSA-N
Mol Weight 265.33 g/mol
Molecular Formula C13H15NO3S
Exact Mass 265.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DW3tuEpMQ2U
Name 2-Oxa-3-azabicyclo[3.2.1]oct-6-ene, 3-[(4-methylphenyl)sulfonyl]-
Alternate Name(s) 3-[(4-methylphenyl)sulfonyl]-2-oxa-3-azabicyclo[3.2.1]oct-6-ene
CAS Registry Number 81640-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3S
InChI InChI=1S/C13H15NO3S/c1-10-2-6-13(7-3-10)18(15,16)14-9-11-4-5-12(8-11)17-14/h2-7,11-12H,8-9H2,1H3
InChIKey QZFYJRRAJZSTJM-UHFFFAOYSA-N
Molecular Weight 265.327 g/mol
SMILES C12ON(S(c3ccc(cc3)C)(=O)=O)CC(C=C1)C2
SPLASH splash10-0a4i-2920000000-d93758a74f499ae3b071
Source of Spectrum K-116-1115-0
Wiley ID 1268819