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

*Links on SpectraBase are not permalinks.
3,8-Dimethyl-4-(methoxycarbonyl)-5-[(p-chloroanilino)carbonyl]-pyrrolo[1,2-b]-(1,2,4)-triazole
SpectraBase Compound ID DVir1UsfcE5
InChI InChI=1S/C16H15ClN4O3/c1-8-12(16(23)24-3)13(14-18-9(2)20-21(8)14)15(22)19-11-6-4-10(17)5-7-11/h4-7H,1-3H3,(H,18,20)(H,19,22)
InChIKey KQOQJWCQBNIGJY-UHFFFAOYSA-N
Mol Weight 346.77 g/mol
Molecular Formula C16H15ClN4O3
Exact Mass 346.083268 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 8sOmVVTi7Y4
Name 3,8-Dimethyl-4-(methoxycarbonyl)-5-[(p-chloroanilino)carbonyl]-pyrrolo[1,2-b]-(1,2,4)-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClN4O3
InChI InChI=1S/C16H15ClN4O3/c1-8-12(16(23)24-3)13(14-18-9(2)20-21(8)14)15(22)19-11-6-4-10(17)5-7-11/h4-7H,1-3H3,(H,18,20)(H,19,22)
InChIKey KQOQJWCQBNIGJY-UHFFFAOYSA-N
Molecular Weight 346.774 g/mol
SMILES N1C(=N[n]2c1c(C(Nc1ccc(cc1)Cl)=O)c(c2C)C(=O)OC)C
SPLASH splash10-01bi-0932000000-1bc4e1495951c4839332
Source of Spectrum D1-2006-1737-8
Wiley ID 1614108