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

*Links on SpectraBase are not permalinks.

3-Hydroxymethyl-N-(4'-methyl-3'-pentenyl)-1,2,3,4-tetrahydroisoquinoline

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

3-Hydroxymethyl-N-(4'-methyl-3'-pentenyl)-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID 37t6dG9mV1s
InChI InChI=1S/C16H23NO/c1-13(2)6-5-9-17-11-15-8-4-3-7-14(15)10-16(17)12-18/h3-4,6-8,16,18H,5,9-12H2,1-2H3
InChIKey HMPMPQBFQAVAED-UHFFFAOYSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 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 CWlW3bX1sPU
Name 3-Hydroxymethyl-N-(4'-methyl-3'-pentenyl)-1,2,3,4-tetrahydroisoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.177964364 u
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-13(2)6-5-9-17-11-15-8-4-3-7-14(15)10-16(17)12-18/h3-4,6-8,16,18H,5,9-12H2,1-2H3
InChIKey HMPMPQBFQAVAED-UHFFFAOYSA-N
Molecular Weight 245.366 g/mol
SMILES C1N(C(CC=2C=CC=CC12)CO)CCC=C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965796