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

*Links on SpectraBase are not permalinks.

(3aS,4R,6R,6aR)-2,2,6-trimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-4,5-dicarboxylic acid O4-methyl ester O5-(phenylmethyl) ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(3aS,4R,6R,6aR)-2,2,6-trimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-4,5-dicarboxylic acid O4-methyl ester O5-(phenylmethyl) ester
SpectraBase Compound ID LHYoVhUiZgI
InChI InChI=1S/C18H23NO6/c1-11-14-15(25-18(2,3)24-14)13(16(20)22-4)19(11)17(21)23-10-12-8-6-5-7-9-12/h5-9,11,13-15H,10H2,1-4H3/t11-,13-,14-,15+/m1/s1
InChIKey XPXHSIOENZLJPS-NGFQHRJXSA-N
Mol Weight 349.38 g/mol
Molecular Formula C18H23NO6
Exact Mass 349.152537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID I74qtGqDziU
Name (3as,4R,6R,6ar)-2,2,6-Trimethyl-3A,4,6,6A-tetrahydro-[1,3]dioxolo[4,5-C]pyrrole-4,5-dicarboxylic acid O4-methyl ester O5-(phenylmethyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.152537459 u
Formula C18H23NO6
InChI InChI=1S/C18H23NO6/c1-11-14-15(25-18(2,3)24-14)13(16(20)22-4)19(11)17(21)23-10-12-8-6-5-7-9-12/h5-9,11,13-15H,10H2,1-4H3/t11-,13-,14-,15+/m1/s1
InChIKey XPXHSIOENZLJPS-NGFQHRJXSA-N
Molecular Weight 349.383 g/mol
SMILES [C@@]1(N([C@@]([C@]2(OC(O[C@@]12[H])(C)C)[H])(C)[H])C(OCC1=CC=CC=C1)=O)(C(=O)OC)[H]