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

*Links on SpectraBase are not permalinks.

Methyl 3-(3-(cyclopentyloxy)-4-methoxyphenyl)-4-nitrobutanoate

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

Methyl 3-(3-(cyclopentyloxy)-4-methoxyphenyl)-4-nitrobutanoate
SpectraBase Compound ID G9HBrRHw9qb
InChI InChI=1S/C17H23NO6/c1-22-15-8-7-12(9-16(15)24-14-5-3-4-6-14)13(11-18(20)21)10-17(19)23-2/h7-9,13-14H,3-6,10-11H2,1-2H3
InChIKey CZSSOJJXDAPWFF-UHFFFAOYSA-N
Mol Weight 337.37 g/mol
Molecular Formula C17H23NO6
Exact Mass 337.152537 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 HjiCBoi3INT
Name Methyl 3-(3-cyclopentyloxy-4-methoxyphenyl)-4-nitrobutanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.152537459 u
Formula C17H23NO6
InChI InChI=1S/C17H23NO6/c1-22-15-8-7-12(9-16(15)24-14-5-3-4-6-14)13(11-18(20)21)10-17(19)23-2/h7-9,13-14H,3-6,10-11H2,1-2H3
InChIKey CZSSOJJXDAPWFF-UHFFFAOYSA-N
Molecular Weight 337.372 g/mol
SMILES C(N(=O)=O)C(C1=CC(OC2CCCC2)=C(C=C1)OC)CC(=O)OC