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

*Links on SpectraBase are not permalinks.
(2R(*),3R(*),4R(*))-3-Acetoxy-2-(benzyloxy)-4-(ethoxycarbonyl)-1-(phenylsulfonyl)-1,2,3,4-tetrahydropyridine
SpectraBase Compound ID 4eOssCBt1Av
InChI InChI=1S/C23H25NO7S/c1-3-29-23(26)20-14-15-24(32(27,28)19-12-8-5-9-13-19)22(21(20)31-17(2)25)30-16-18-10-6-4-7-11-18/h4-15,20-22H,3,16H2,1-2H3/t20-,21-,22-/m1/s1
InChIKey NTOWXSSGLLFKHY-YPAWHYETSA-N
Mol Weight 459.51 g/mol
Molecular Formula C23H25NO7S
Exact Mass 459.135173 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 JGYvZxEjDDj
Name (2R(*),3R(*),4R(*))-3-Acetoxy-2-(benzyloxy)-4-(ethoxycarbonyl)-1-(phenylsulfonyl)-1,2,3,4-tetrahydropyridine
Alternate Name(s) Ethyl (2R,3R,4R)-3-(acetyloxy)-2-(benzyloxy)-1-(phenylsulfonyl)-1,2,3,4-tetrahydro-4-pyridinecarboxylate
CAS Registry Number 130147-08-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25NO7S
InChI InChI=1S/C23H25NO7S/c1-3-29-23(26)20-14-15-24(32(27,28)19-12-8-5-9-13-19)22(21(20)31-17(2)25)30-16-18-10-6-4-7-11-18/h4-15,20-22H,3,16H2,1-2H3/t20-,21-,22-/m1/s1
InChIKey NTOWXSSGLLFKHY-YPAWHYETSA-N
Molecular Weight 459.513 g/mol
SMILES c1(S(N2[C@@]([C@](OC(=O)C)([C@@](C=C2)(C(=O)OCC)[H])[H])(OCc2ccccc2)[H])(=O)=O)ccccc1
SPLASH splash10-0006-9010000000-9fc4ddd77ba7e6543fad
Source of Spectrum C-113-1728-45
Wiley ID 1390197