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N'-ANDROSTAN-17-YLIDENE-4-METHYLBENZENESULFONOHYDRAZIDE
SpectraBase Compound ID G74szsDBhxa
InChI InChI=1S/C26H38N2O2S/c1-18-7-10-20(11-8-18)31(29,30)28-27-24-14-13-22-21-12-9-19-6-4-5-16-25(19,2)23(21)15-17-26(22,24)3/h7-8,10-11,19,21-23,28H,4-6,9,12-17H2,1-3H3/b27-24+/t19?,21?,22?,23?,25-,26-/m0/s1
InChIKey ZXLKYQRPXKTWOB-XDGRMVDDSA-N
Mol Weight 442.7 g/mol
Molecular Formula C26H38N2O2S
Exact Mass 442.2654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eISB86qPo
Name N'-ANDROSTAN-17-YLIDENE-4-METHYLBENZENESULFONOHYDRAZIDE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 442.265399644 u
Formula C26H38N2O2S
InChI InChI=1S/C26H38N2O2S/c1-18-7-10-20(11-8-18)31(29,30)28-27-24-14-13-22-21-12-9-19-6-4-5-16-25(19,2)23(21)15-17-26(22,24)3/h7-8,10-11,19,21-23,28H,4-6,9,12-17H2,1-3H3/b27-24+/t19?,21?,22?,23?,25-,26-/m0/s1
InChIKey ZXLKYQRPXKTWOB-XDGRMVDDSA-N
Molecular Weight 442.662 g/mol
Nominal Mass 442 u
Number of Peaks 277
SMILES N(\N=C/1CCC2C3CCC4CCCC[C@@]4(C3CC[C@]12C)C)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-052e-9630000000-c159bb02601e3f1f870c
Source File Reference LMCM-56546-927M
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms N'-[(2S,14E,15S)-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-ylidene]-4-methylbenzene-1-sulfonohydrazide
Wiley ID 8_13851