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2-(6-Aminopurin-3-yl)-1,4,7,10,13-pentaoxacyclopentadecane

View entire compound with spectra: 1 NMR, and 1 FTIR

2-(6-Aminopurin-3-yl)-1,4,7,10,13-pentaoxacyclopentadecane
SpectraBase Compound ID 4Wep4T93kfD
InChI InChI=1S/C16H25N5O5/c17-15-14-16(19-11-18-14)21(12-20-15)9-13-10-25-6-5-23-2-1-22-3-4-24-7-8-26-13/h11-13H,1-10,17H2
InChIKey IDNUXFQOVJCUTF-UHFFFAOYSA-N
Mol Weight 367.41 g/mol
Molecular Formula C16H25N5O5
Exact Mass 367.185569 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6EK1kTj6B86
Name 2-(6-Aminopurin-3-yl)-1,4,7,10,13-pentaoxacyclopentadecane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.185568920 u
Formula C16H25N5O5
InChI InChI=1S/C16H25N5O5/c17-15-14-16(19-11-18-14)21(12-20-15)9-13-10-25-6-5-23-2-1-22-3-4-24-7-8-26-13/h11-13H,1-10,17H2
InChIKey IDNUXFQOVJCUTF-UHFFFAOYSA-N
Molecular Weight 367.406 g/mol
SMILES C=12C(N(CC3OCCOCCOCCOCCOC3)C=NC1N)=NC=N2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.924959