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

*Links on SpectraBase are not permalinks.
3H-[1,3]Dioxolo[4,5-f][1,2,3]triazolo[5,1-a]isoindole-3-carboxylic acid, 3a,9-dihydro-, ethyl ester
SpectraBase Compound ID 9BPMjydakeD
InChI InChI=1S/C13H13N3O4/c1-2-18-13(17)11-12-8-4-10-9(19-6-20-10)3-7(8)5-16(12)15-14-11/h3-4,11-12H,2,5-6H2,1H3
InChIKey ONSXNHMODVWLBB-UHFFFAOYSA-N
Mol Weight 275.26 g/mol
Molecular Formula C13H13N3O4
Exact Mass 275.090606 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 4BvSBxG7eX0
Name 3H-[1,3]Dioxolo[4,5-f][1,2,3]triazolo[5,1-a]isoindole-3-carboxylic acid, 3a,9-dihydro-, ethyl ester
CAS Registry Number 100606-49-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O4
InChI InChI=1S/C13H13N3O4/c1-2-18-13(17)11-12-8-4-10-9(19-6-20-10)3-7(8)5-16(12)15-14-11/h3-4,11-12H,2,5-6H2,1H3
InChIKey ONSXNHMODVWLBB-UHFFFAOYSA-N
Molecular Weight 275.264 g/mol
SMILES C1(N=NN2C1c1cc3OCOc3cc1C2)C(=O)OCC
SPLASH splash10-03di-0900000000-a1bac34a73e22628f775
Source of Spectrum J-51-1123-6
Synonyms 3-(ethoxycarbonyl)-5,6-(methylenedioxy)-3,3a-dihydro-8H-[1,2,3]triazolo[5,1-a]isoindole Ethyl 3a,9-dihydro-3H-[1,3]dioxolo[4,5-f][1,2,3]triazolo[5,1-a]isoindole-3-carboxylate
Wiley ID 1278964