SpectraBase Spectrum ID |
BiJfkkxGnYu |
Name |
(.+/-.)-dropropizine, bis(2-methylpropionate) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
376.236207514 u |
Formula |
C21H32N2O4 |
InChI |
InChI=1S/C21H32N2O4/c1-16(2)20(24)26-15-19(27-21(25)17(3)4)14-22-10-12-23(13-11-22)18-8-6-5-7-9-18/h5-9,16-17,19H,10-15H2,1-4H3 |
InChIKey |
YNCBFCVIHZNCHZ-UHFFFAOYSA-N |
Molecular Weight |
376.497 g/mol |
SMILES |
C(C(COC(C(C)C)=O)OC(C(C)C)=O)N1CCN(CC1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92683 |