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(1S,2R,6S)-2-(Hydroxymethyl)-6-[[N-(2R)-2-[[(tert-butyldimethylsilyl)oxy]methyl]-3,3-dimethylbutyl]-N-methylamino]methyl]-4,4-dimethylcyclohexane-1-ol

View entire compound with spectra: 1 MS (GC)

(1S,2R,6S)-2-(Hydroxymethyl)-6-[[N-(2R)-2-[[(tert-butyldimethylsilyl)oxy]methyl]-3,3-dimethylbutyl]-N-methylamino]methyl]-4,4-dimethylcyclohexane-1-ol
SpectraBase Compound ID 1il00Jt5Wn8
InChI InChI=1S/C18H37NO3/c1-17(2,3)15(12-21)10-19(6)9-13-7-18(4,5)8-14(11-20)16(13)22/h13-16,20-22H,7-12H2,1-6H3/t13-,14+,15+,16-/m0/s1
InChIKey RNSGYSBCIGGOOE-JJXSEGSLSA-N
Mol Weight 315.5 g/mol
Molecular Formula C18H37NO3
Exact Mass 315.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IesN8M0xbDO
Name (1S,2R,6S)-2-(Hydroxymethyl)-6-[[N-(2R)-2-[[(tert-butyldimethylsilyl)oxy]methyl]-3,3-dimethylbutyl]-N-methylamino]methyl]-4,4-dimethylcyclohexane-1-ol
Comments Removed - expert review: contamination (acetone))
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H37NO3
InChI InChI=1S/C18H37NO3/c1-17(2,3)15(12-21)10-19(6)9-13-7-18(4,5)8-14(11-20)16(13)22/h13-16,20-22H,7-12H2,1-6H3/t13-,14+,15+,16-/m0/s1
InChIKey RNSGYSBCIGGOOE-JJXSEGSLSA-N
Molecular Weight 315.498 g/mol
SMILES OC[C@@]1([C@]([C@@](CC(C1)(C)C)(CN(C[C@@](C(C)(C)C)(CO)[H])C)[H])(O)[H])[H]
SPLASH splash10-0a4i-9000000000-53b5ea2085c90d914970
Source of Spectrum J-63-2558-7
Synonyms (1S,2R,6S)-2-Hydroxymethyl-6-{[((R)-2-hydroxymethyl-3,3-dimethyl-butyl)-methyl-amino]-methyl}-4,4-dimethyl-cyclohexanol (1S,2R,6S)-2-(hydroxymethyl)-6-[[[(2R)-2-(hydroxymethyl)-3,3-dimethylbutyl]-methylamino]methyl]-4,4-dimethyl-1-cyclohexanol (1S,2R,6S)-2-(hydroxymethyl)-6-[[[(2R)-2-(hydroxymethyl)-3,3-dimethylbutyl]-methylamino]methyl]-4,4-dimethylcyclohexan-1-ol (1S,2R,6S)-2-(hydroxymethyl)-6-[[[(2R)-2-(hydroxymethyl)-3,3-dimethyl-butyl]-methyl-amino]methyl]-4,4-dimethyl-cyclohexanol (1S,2R,6S)-2-(hydroxymethyl)-6-[[[(2R)-2-(hydroxymethyl)-3,3-dimethyl-butyl]-methyl-amino]methyl]-4,4-dimethyl-cyclohexan-1-ol
Wiley ID 1316074