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

*Links on SpectraBase are not permalinks.
RCS-4 N-(4-hydroxypentyl) metabolite
SpectraBase Compound ID 9Q0kPltonWM
InChI InChI=1S/C21H23NO3/c1-15(23)6-5-13-22-14-19(18-7-3-4-8-20(18)22)21(24)16-9-11-17(25-2)12-10-16/h3-4,7-12,14-15,23H,5-6,13H2,1-2H3
InChIKey OAAZEFGKZWEFTG-UHFFFAOYSA-N
Mol Weight 337.42 g/mol
Molecular Formula C21H23NO3
Exact Mass 337.167794 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 69RIN69i6Od
Name RCS-4 N-(4-hydroxypentyl) metabolite
Alternate Name(s) (1-(4-hydroxypentyl)-1H-indol-3-yl)(4-methoxyphenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO3
InChI InChI=1S/C21H23NO3/c1-15(23)6-5-13-22-14-19(18-7-3-4-8-20(18)22)21(24)16-9-11-17(25-2)12-10-16/h3-4,7-12,14-15,23H,5-6,13H2,1-2H3
InChIKey OAAZEFGKZWEFTG-UHFFFAOYSA-N
Molecular Weight 337.419 g/mol
SMILES OC(CCC[n]1cc(c2ccccc12)C(c1ccc(cc1)OC)=O)C
SPLASH splash10-000i-4941000000-6b60a039f17cf930ed1c
Source of Spectrum SWG-33-3310-0
Wiley ID 1810163