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

*Links on SpectraBase are not permalinks.

Cinnamolaurine P891

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Cinnamolaurine P891
SpectraBase Compound ID Jwa7gY6b7MN
InChI InChI=1S/C18H19NO3/c1-19-7-6-13-9-17-18(22-11-21-17)10-15(13)16(19)8-12-2-4-14(20)5-3-12/h2-5,9-10,16,20H,6-8,11H2,1H3
InChIKey VTOOEPLHEDZMBL-UHFFFAOYSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5nmMNQmrZm3
Name Cinnamolaurine P891
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.136493473 u
Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-19-7-6-13-9-17-18(22-11-21-17)10-15(13)16(19)8-12-2-4-14(20)5-3-12/h2-5,9-10,16,20H,6-8,11H2,1H3
InChIKey VTOOEPLHEDZMBL-UHFFFAOYSA-N
Molecular Weight 297.354 g/mol
SMILES C1=2C(N(C)CCC2C=C2C(=C1)OCO2)CC1=CC=C(C=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.868786