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1-tert-Butoxycarbonyl-4-hydroxy-4-[3-(methylthio)phenyl]piperidine
SpectraBase Compound ID 4Cg3liBB4ZY
InChI InChI=1S/C17H25NO3S/c1-16(2,3)21-15(19)18-10-8-17(20,9-11-18)13-6-5-7-14(12-13)22-4/h5-7,12,20H,8-11H2,1-4H3
InChIKey MPCBFZJWRUFXRZ-UHFFFAOYSA-N
Mol Weight 323.45 g/mol
Molecular Formula C17H25NO3S
Exact Mass 323.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lCconoDIes
Name 1-tert-Butoxycarbonyl-4-hydroxy-4-[3-(methylthio)phenyl]piperidine
Appearance Gum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO3S
InChI InChI=1S/C17H25NO3S/c1-16(2,3)21-15(19)18-10-8-17(20,9-11-18)13-6-5-7-14(12-13)22-4/h5-7,12,20H,8-11H2,1-4H3
InChIKey MPCBFZJWRUFXRZ-UHFFFAOYSA-N
Instrument Name HP 5970A
Ionization Type EI
Literature Reference DOI 10.1021/jm901689v
Molecular Weight 323.451 g/mol
SMILES OC1(c2cc(ccc2)SC)CCN(CC1)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-9010000000-6be497307e2c0d0d6b3c
Source of Spectrum AF-53-2518-13
Wiley ID 1846356