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3-(9-oxo-9H-naphtho[1',2':4,5][1,3]thiazolo[3,2-b][1,2,4]triazin-10-yl)propanoic acid

View entire compound with spectra: 1 MS (GC)

3-(9-oxo-9H-naphtho[1',2':4,5][1,3]thiazolo[3,2-b][1,2,4]triazin-10-yl)propanoic acid
SpectraBase Compound ID BYobOJyEMJG
InChI InChI=1S/C16H11N3O3S/c20-13(21)8-6-11-15(22)17-16-19(18-11)14-10-4-2-1-3-9(10)5-7-12(14)23-16/h1-5,7H,6,8H2,(H,20,21)
InChIKey RMRWKVKEKSKGOG-UHFFFAOYSA-N
Mol Weight 325.34 g/mol
Molecular Formula C16H11N3O3S
Exact Mass 325.052112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAYG3PnmfQn
Name 3-(9-oxo-9H-naphtho[1',2':4,5][1,3]thiazolo[3,2-b][1,2,4]triazin-10-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N3O3S
InChI InChI=1S/C16H11N3O3S/c20-13(21)8-6-11-15(22)17-16-19(18-11)14-10-4-2-1-3-9(10)5-7-12(14)23-16/h1-5,7H,6,8H2,(H,20,21)
InChIKey RMRWKVKEKSKGOG-UHFFFAOYSA-N
Molecular Weight 325.342 g/mol
SMILES OC(CCC1=NN2C(=NC1=O)Sc1c2c2c(cc1)cccc2)=O
SPLASH splash10-004i-0391000000-b8e6cad5a8eac52c73b5
Source of Spectrum Y-29-101-4
Wiley ID 1323874