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

*Links on SpectraBase are not permalinks.

RCS-4-M (5-HO-pentyl-) AC

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

RCS-4-M (5-HO-pentyl-) AC
SpectraBase Compound ID BpbhwEK9rZ3
InChI InChI=1S/C23H25NO4/c1-17(25)28-15-7-3-6-14-24-16-21(20-8-4-5-9-22(20)24)23(26)18-10-12-19(27-2)13-11-18/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3
InChIKey JTXHUPRMTGLMGP-UHFFFAOYSA-N
Mol Weight 379.46 g/mol
Molecular Formula C23H25NO4
Exact Mass 379.178358 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 ILmHXyqUGQi
Name rcs-4-m (5-ho-Pentyl-) ac P1352
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.178358285 u
Formula C23H25NO4
InChI InChI=1S/C23H25NO4/c1-17(25)28-15-7-3-6-14-24-16-21(20-8-4-5-9-22(20)24)23(26)18-10-12-19(27-2)13-11-18/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3
InChIKey JTXHUPRMTGLMGP-UHFFFAOYSA-N
Molecular Weight 379.456 g/mol
SMILES C1=C2C(=CN(C2=CC=C1)CCCCCOC(C)=O)C(C1=CC=C(C=C1)OC)=O