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3-Methoxy-4-(2,2,6-trimethylcyclohex-5-enyl)butan-4-ol-2-one p-toluenesulfonylhydrazone

View entire compound with spectra: 2 MS (GC)

3-Methoxy-4-(2,2,6-trimethylcyclohex-5-enyl)butan-4-ol-2-one p-toluenesulfonylhydrazone
SpectraBase Compound ID X8vOXgRa8S
InChI InChI=1S/C21H32N2O4S/c1-14-9-11-17(12-10-14)28(25,26)23-22-16(3)20(27-6)19(24)18-15(2)8-7-13-21(18,4)5/h8-12,18-20,23-24H,7,13H2,1-6H3/b22-16+
InChIKey NDZRICQFWFQSMS-CJLVFECKSA-N
Mol Weight 408.6 g/mol
Molecular Formula C21H32N2O4S
Exact Mass 408.208279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVi4zEOhzVs
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H32N2O4S
InChI InChI=1S/C21H32N2O4S/c1-14-9-11-17(12-10-14)28(25,26)23-22-16(3)20(27-6)19(24)18-15(2)8-7-13-21(18,4)5/h8-12,18-20,23-24H,7,13H2,1-6H3/b22-16+
InChIKey NDZRICQFWFQSMS-CJLVFECKSA-N
Molecular Weight 408.2075
SMILES N(S(c1ccc(C)cc1)(=O)=O)\N=C\(C(C(O)C1C(C)=CCCC1(C)C)OC)C
SPLASH splash10-0udl-9510000000-85f00a5ccbbaf4607c98
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany