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N-[(E)-2-Methyl-3-{3,5-dimethoxyphenyl}-2-propenoyl]bornane-10,2-sultam
SpectraBase Compound ID 7EDxDdCj7FP
InChI InChI=1S/C22H29NO5S/c1-14(8-15-9-17(27-4)12-18(10-15)28-5)20(24)23-19-11-16-6-7-22(19,21(16,2)3)13-29(23,25)26/h8-10,12,16,19H,6-7,11,13H2,1-5H3/b14-8+/t16-,19+,22-/m0/s1
InChIKey PXWLEVBBHORPDW-VXAVSMMWSA-N
Mol Weight 419.54 g/mol
Molecular Formula C22H29NO5S
Exact Mass 419.176644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRl7pSbQy3J
Name N-[(E)-2-Methyl-3-{3,5-dimethoxyphenyl}-2-propenoyl]bornane-10,2-sultam
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5S
InChI InChI=1S/C22H29NO5S/c1-14(8-15-9-17(27-4)12-18(10-15)28-5)20(24)23-19-11-16-6-7-22(19,21(16,2)3)13-29(23,25)26/h8-10,12,16,19H,6-7,11,13H2,1-5H3/b14-8+/t16-,19+,22-/m0/s1
InChIKey PXWLEVBBHORPDW-VXAVSMMWSA-N
Molecular Weight 419.536 g/mol
SMILES [C@@]12(N(S(C[C@]11C([C@](C2)(CC1)[H])(C)C)(=O)=O)C(\C(=C\c1cc(OC)cc(c1)OC)C)=O)[H]
SPLASH splash10-01b9-0000900000-72c0a211577f41c0576b
Source of Spectrum KC-57-7610-8
Synonyms 4-[(2E)-3-(3,5-dimethoxyphenyl)-2-methyl-2-propenoyl]-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
Wiley ID 1625598