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N-(p-toylsulfonyl)-6(S)-bromo-10(S)-hydroxy-7-aza-3-oxaspiro[4.5]decane
SpectraBase Compound ID XEi2kgy0zX
InChI InChI=1S/C15H20BrNO4S/c1-11-2-4-12(5-3-11)22(19,20)17-8-6-13(18)15(14(17)16)7-9-21-10-15/h2-5,13-14,18H,6-10H2,1H3/t13-,14+,15?/m0/s1
InChIKey HLICBJSSTWXVIG-SNTRVMSOSA-N
Mol Weight 390.29 g/mol
Molecular Formula C15H20BrNO4S
Exact Mass 389.029642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IA9sXGfvJPj
Name N-(p-toylsulfonyl)-6(S)-bromo-10(S)-hydroxy-7-aza-3-oxaspiro[4.5]decane
CAS Registry Number 117754-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20BrNO4S
InChI InChI=1S/C15H20BrNO4S/c1-11-2-4-12(5-3-11)22(19,20)17-8-6-13(18)15(14(17)16)7-9-21-10-15/h2-5,13-14,18H,6-10H2,1H3/t13-,14+,15?/m0/s1
InChIKey HLICBJSSTWXVIG-SNTRVMSOSA-N
Molecular Weight 390.292 g/mol
SMILES O[C@]1(CCN(S(c2ccc(cc2)C)(=O)=O)[C@](C11COCC1)(Br)[H])[H]
SPLASH splash10-0019-0292000000-f65d93758087802289b5
Source of Spectrum J-53-5498-3
Synonyms (6S,10S)-6-bromo-7-[(4-methylphenyl)sulfonyl]-2-oxa-7-azaspiro[4.5]decan-10-ol
Wiley ID 1364248