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2,6,6-Trimethyl-4,5,6,7-tetrahydro-1,3-benzoxazol-4-one - N-tosyloxime
SpectraBase Compound ID 61oCh3W5PFz
InChI InChI=1S/C17H20N2O4S/c1-11-5-7-13(8-6-11)24(20,21)23-19-14-9-17(3,4)10-15-16(14)18-12(2)22-15/h5-8H,9-10H2,1-4H3/b19-14+
InChIKey NHTKZCJYSCRDPR-XMHGGMMESA-N
Mol Weight 348.42 g/mol
Molecular Formula C17H20N2O4S
Exact Mass 348.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ke9TraPGFBM
Name 2,6,6-Trimethyl-4,5,6,7-tetrahydro-1,3-benzoxazol-4-one - N-tosyloxime
Alternate Name(s) [(4E)-2,6,6-trimethyl-4,5,6,7-tetrahydro-1,3-benzoxazol-4-ylidene]amino 4-methylbenzene-1-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O4S
InChI InChI=1S/C17H20N2O4S/c1-11-5-7-13(8-6-11)24(20,21)23-19-14-9-17(3,4)10-15-16(14)18-12(2)22-15/h5-8H,9-10H2,1-4H3/b19-14+
InChIKey NHTKZCJYSCRDPR-XMHGGMMESA-N
Molecular Weight 348.417 g/mol
SMILES c12c(oc(n2)C)CC(C\C1=N\OS(c1ccc(cc1)C)(=O)=O)(C)C
SPLASH splash10-0006-9430000000-b2e9c456e429db68b697
Source of Spectrum Y-38-91-3
Wiley ID 848207