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

*Links on SpectraBase are not permalinks.

N,N'-diphenylacetamidinium (phenylsulfonyl)acetate

View entire compound with spectra: 2 NMR

N,N'-diphenylacetamidinium (phenylsulfonyl)acetate
SpectraBase Compound ID 6So4rs2c5u1
InChI InChI=1S/C14H16N2.C8H8O4S/c1-12(15-13-8-4-2-5-9-13)16-14-10-6-3-7-11-14;9-8(10)6-13(11,12)7-4-2-1-3-5-7/h2-12,15-16H,1H3;1-5H,6H2,(H,9,10)/p-1
InChIKey UPWYGOVKTBOEFV-UHFFFAOYSA-M
Mol Weight 411.5 g/mol
Molecular Formula C22H23N2O4S
Exact Mass 411.137853 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 2AgOV8iTCcQ
Name N,N'-Diphenylacetamidinium (phenylsulfonyl)acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.137853399 u
Formula C22H23N2O4S
InChI InChI=1S/C14H16N2.C8H8O4S/c1-12(15-13-8-4-2-5-9-13)16-14-10-6-3-7-11-14;9-8(10)6-13(11,12)7-4-2-1-3-5-7/h2-12,15-16H,1H3;1-5H,6H2,(H,9,10)/p-1
InChIKey UPWYGOVKTBOEFV-UHFFFAOYSA-M
SMILES C=1C(=CC=CC1)S(=O)(=O)CC([O-])=O.N(C1=CC=CC=C1)C(NC=1C=CC=CC1)C