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2-n-Butyl-3-(p-hydroxymethyl)benzenesulfonyl)-4,5,6,7-tetrahydro-3aH-isoxazolo[2,3-a]pyridine
SpectraBase Compound ID 8xoXBahlYo9
InChI InChI=1S/C18H25NO4S/c1-2-3-7-17-18(16-6-4-5-12-19(16)23-17)24(21,22)15-10-8-14(13-20)9-11-15/h8-11,16,20H,2-7,12-13H2,1H3
InChIKey ZYQDCLMKBWUQCO-UHFFFAOYSA-N
Mol Weight 351.46 g/mol
Molecular Formula C18H25NO4S
Exact Mass 351.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImZOqy6PZiD
Name 2-n-Butyl-3-(p-hydroxymethyl)benzenesulfonyl)-4,5,6,7-tetrahydro-3aH-isoxazolo[2,3-a]pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO4S
InChI InChI=1S/C18H25NO4S/c1-2-3-7-17-18(16-6-4-5-12-19(16)23-17)24(21,22)15-10-8-14(13-20)9-11-15/h8-11,16,20H,2-7,12-13H2,1H3
InChIKey ZYQDCLMKBWUQCO-UHFFFAOYSA-N
Molecular Weight 351.461 g/mol
SMILES OCc1ccc(S(C2=C(ON3C2CCCC3)CCCC)(=O)=O)cc1
SPLASH splash10-0k96-9504000000-22347eb1c3a194b9bc6c
Source of Spectrum J-73-8067-57
Wiley ID 1668700