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

*Links on SpectraBase are not permalinks.
1,3,5-triazin-2-amine, 4-[[5-(1,3-benzodioxol-5-yl)-2H-tetrazol-2-yl]methyl]-6-(1-piperidinyl)-
SpectraBase Compound ID LLsfHJGZ3q3
InChI InChI=1S/C17H19N9O2/c18-16-19-14(20-17(21-16)25-6-2-1-3-7-25)9-26-23-15(22-24-26)11-4-5-12-13(8-11)28-10-27-12/h4-5,8H,1-3,6-7,9-10H2,(H2,18,19,20,21)
InChIKey GTBVHDOQXFNKCS-UHFFFAOYSA-N
Mol Weight 381.4 g/mol
Molecular Formula C17H19N9O2
Exact Mass 381.166171 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 uqr8IKsGEc
Name 4-[[5-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-2-yl]methyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N9O2
InChI InChI=1S/C17H19N9O2/c18-16-19-14(20-17(21-16)25-6-2-1-3-7-25)9-26-23-15(22-24-26)11-4-5-12-13(8-11)28-10-27-12/h4-5,8H,1-3,6-7,9-10H2,(H2,18,19,20,21)
InChIKey GTBVHDOQXFNKCS-UHFFFAOYSA-N
Molecular Weight 381.400 g/mol
SMILES Nc1nc(nc(n1)C[n]1nc(-c2cc3OCOc3cc2)nn1)N1CCCCC1
SPLASH splash10-00dj-6947000000-eaf9a1f09b441cf26829
Synonyms 4-[[5-(1,3-benzodioxol-5-yl)-2-tetrazolyl]methyl]-6-(1-piperidinyl)-1,3,5-triazin-2-amine 4-[[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]methyl]-6-(1-piperidyl)-1,3,5-triazin-2-amine 4-[[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]methyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine [4-[[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]methyl]-6-piperidino-s-triazin-2-yl]amine
Wiley ID 1453000