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

*Links on SpectraBase are not permalinks.

5-(4-Methoxybenzoyl)-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

5-(4-Methoxybenzoyl)-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester
SpectraBase Compound ID AMPY4dnf5ma
InChI InChI=1S/C19H22N4O4S/c1-3-27-18(25)14-17-23(22-20-14)21-19(10-4-5-11-19)16(28-17)15(24)12-6-8-13(26-2)9-7-12/h6-9,16,21H,3-5,10-11H2,1-2H3
InChIKey UMQBCJOJQRNYDY-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C19H22N4O4S
Exact Mass 402.136176 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 5wl2DXyYbM7
Name 5-(4-Methoxybenzoyl)-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester
Appearance Purple powder
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N4O4S
InChI InChI=1S/C19H22N4O4S/c1-3-27-18(25)14-17-23(22-20-14)21-19(10-4-5-11-19)16(28-17)15(24)12-6-8-13(26-2)9-7-12/h6-9,16,21H,3-5,10-11H2,1-2H3
InChIKey UMQBCJOJQRNYDY-UHFFFAOYSA-N
Instrument Name GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2554
Molecular Weight 402.469 g/mol
SMILES N1[n]2nnc(c2SC(C11CCCC1)C(c1ccc(cc1)OC)=O)C(=O)OCC
SPLASH splash10-000i-1901000000-6a73f42ea736c29ade21
Source of Spectrum Y-54-145-9c
Wiley ID 1877787