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

*Links on SpectraBase are not permalinks.
1,2-Dicarbethoxy-5,5-dimethyl-3-phenyl-delta3-1,2,4-triazoline
SpectraBase Compound ID 7qVwsIZjZO8
InChI InChI=1S/C16H21N3O4/c1-5-22-14(20)18-13(12-10-8-7-9-11-12)17-16(3,4)19(18)15(21)23-6-2/h7-11H,5-6H2,1-4H3
InChIKey FIRHUCPQBGQKCA-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C16H21N3O4
Exact Mass 319.153206 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 I3z217w9Pqa
Name 1,2-Dicarbethoxy-5,5-dimethyl-3-phenyl-delta3-1,2,4-triazoline
Alternate Name(s) Diethyl 3,3-dimethyl-5-phenyl-1H-1,2,4-triazole-1,2(3H)-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N3O4
InChI InChI=1S/C16H21N3O4/c1-5-22-14(20)18-13(12-10-8-7-9-11-12)17-16(3,4)19(18)15(21)23-6-2/h7-11H,5-6H2,1-4H3
InChIKey FIRHUCPQBGQKCA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19740570514
Molecular Weight 319.361 g/mol
SMILES C=1(N(N(C(N1)(C)C)C(OCC)=O)C(OCC)=O)c1ccccc1
SPLASH splash10-0w30-0920000000-f29a507140749ba45144
Source of Spectrum H-57-1389-4a
Wiley ID 1797215