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5-(Benzyloxy)-1-(-tert-butoxycarbonyl)-2-mercapto-3-methyl-indol-2-one
SpectraBase Compound ID GR4zDta4OeF
InChI InChI=1S/C21H23NO3S/c1-14-17-12-16(24-13-15-8-6-5-7-9-15)10-11-18(17)22(19(14)26)20(23)25-21(2,3)4/h5-12,26H,13H2,1-4H3
InChIKey LNCSLALBNPFHIY-UHFFFAOYSA-N
Mol Weight 369.48 g/mol
Molecular Formula C21H23NO3S
Exact Mass 369.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNCEopnLW66
Name 5-(Benzyloxy)-1-(-tert-butoxycarbonyl)-2-mercapto-3-methyl-indol-2-one
Alternate Name(s) 5-(Benzyloxy)-1-(-tert-butoxycarbonyl)-2-mercapto-3-methyl-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO3S
InChI InChI=1S/C21H23NO3S/c1-14-17-12-16(24-13-15-8-6-5-7-9-15)10-11-18(17)22(19(14)26)20(23)25-21(2,3)4/h5-12,26H,13H2,1-4H3
InChIKey LNCSLALBNPFHIY-UHFFFAOYSA-N
Molecular Weight 369.479 g/mol
SMILES Sc1[n](C(OC(C)(C)C)=O)c2c(cc(cc2)OCc2ccccc2)c1C
SPLASH splash10-0006-9201000000-7c7a47011968b77f5624
Source of Spectrum C-114-5571-38
Wiley ID 1353677