For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-[N-(9-Fluorenylmethyloxycarbonyl)-(1S)-1-amino-2-(4-methoxybenzyl)-2-oxoethyl]-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane

View entire compound with spectra: 1 MS (GC)

1-[N-(9-Fluorenylmethyloxycarbonyl)-(1S)-1-amino-2-(4-methoxybenzyl)-2-oxoethyl]-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane
SpectraBase Compound ID 3nC61dLBB0S
InChI InChI=1S/C31H31NO7/c1-30-17-37-31(38-18-30,39-19-30)28(27(33)15-20-11-13-21(35-2)14-12-20)32-29(34)36-16-26-24-9-5-3-7-22(24)23-8-4-6-10-25(23)26/h3-14,26,28H,15-19H2,1-2H3,(H,32,34)/t28-,30-,31?/m0/s1
InChIKey NPXNOKKPVJWWIY-GRMXABTLSA-N
Mol Weight 529.59 g/mol
Molecular Formula C31H31NO7
Exact Mass 529.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8WCUDhzTDv5
Name 1-[N-(9-Fluorenylmethyloxycarbonyl)-(1S)-1-amino-2-(4-methoxybenzyl)-2-oxoethyl]-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H31NO7
InChI InChI=1S/C31H31NO7/c1-30-17-37-31(38-18-30,39-19-30)28(27(33)15-20-11-13-21(35-2)14-12-20)32-29(34)36-16-26-24-9-5-3-7-22(24)23-8-4-6-10-25(23)26/h3-14,26,28H,15-19H2,1-2H3,(H,32,34)/t28-,30-,31?/m0/s1
InChIKey NPXNOKKPVJWWIY-GRMXABTLSA-N
Molecular Weight 529.589 g/mol
SMILES N([C@](C12OCC(CO2)(C)CO1)(C(Cc1ccc(cc1)OC)=O)[H])C(OCC1c2c(cccc2)-c2c1cccc2)=O
SPLASH splash10-014i-0000190000-de8dc034e8108f626f00
Source of Spectrum J-63-3642-24a
Wiley ID 1401300