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4-[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-quinoxalinyl)methylcarboxamido]benzoic acid
SpectraBase Compound ID 39mJrAxeyOD
InChI InChI=1S/C21H25N3O3/c1-20(2)9-10-21(3,4)18-17(20)22-12-15(24-18)11-16(25)23-14-7-5-13(6-8-14)19(26)27/h5-8,12H,9-11H2,1-4H3,(H,23,25)(H,26,27)
InChIKey LXOJPHWWGGQTJQ-UHFFFAOYSA-N
Mol Weight 367.45 g/mol
Molecular Formula C21H25N3O3
Exact Mass 367.189592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGGFhsIlfvs
Name 4-[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-quinoxalinyl)methylcarboxamido]benzoic acid
Alternate Name(s) 4-{[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-quinoxalinyl)acetyl]amino}benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O3
InChI InChI=1S/C21H25N3O3/c1-20(2)9-10-21(3,4)18-17(20)22-12-15(24-18)11-16(25)23-14-7-5-13(6-8-14)19(26)27/h5-8,12H,9-11H2,1-4H3,(H,23,25)(H,26,27)
InChIKey LXOJPHWWGGQTJQ-UHFFFAOYSA-N
Molecular Weight 367.449 g/mol
SMILES N(C(Cc1nc2c(nc1)C(C)(C)CCC2(C)C)=O)c1ccc(C(=O)O)cc1
SPLASH splash10-0006-0913000000-b347359efe656158be5f
Source of Spectrum F2-41-3074-9
Wiley ID 1599771