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Butanedioic acid, (bromomethyl)methyl[(phenylmethyl)imino]-, diethyl ester
SpectraBase Compound ID 8Sz6Q5bp2bR
InChI InChI=1S/C17H22BrNO4/c1-4-22-15(20)14(17(3,12-18)16(21)23-5-2)19-11-13-9-7-6-8-10-13/h6-10H,4-5,11-12H2,1-3H3/b19-14+
InChIKey SGZMGWBGGBTBPF-XMHGGMMESA-N
Mol Weight 384.27 g/mol
Molecular Formula C17H22BrNO4
Exact Mass 383.073221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPmIowbzBG
Name Butanedioic acid, (bromomethyl)methyl[(phenylmethyl)imino]-, diethyl ester
CAS Registry Number 107987-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22BrNO4
InChI InChI=1S/C17H22BrNO4/c1-4-22-15(20)14(17(3,12-18)16(21)23-5-2)19-11-13-9-7-6-8-10-13/h6-10H,4-5,11-12H2,1-3H3/b19-14+
InChIKey SGZMGWBGGBTBPF-XMHGGMMESA-N
Molecular Weight 384.270 g/mol
SMILES C(\C(=N\Cc1ccccc1)C(=O)OCC)(C(=O)OCC)(CBr)C
SPLASH splash10-03dl-0039000000-917f93f6f68c99439aba
Source of Spectrum F-45-84-16
Synonyms Diethyl (3Z)-2-(bromomethyl)-2-methyl-3-{[(Z)-phenylmethyl]imino}butanedioate Diethyl 2-benzylimino-3-bromomethyl-3-methylsuccinate Diethyl 3-bromomethyl-3-methyl-2-benzyliminosuccinate
Wiley ID 1360996