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(2Z,2'Z)-Dimethyl 2,2'-(7-bromo-3-methyl-1H-benzo[b][1,4]diazepine-2,4(3H,5H)-diylidene)diacetate
SpectraBase Compound ID 4xmR8JOugen
InChI InChI=1S/C16H17BrN2O4/c1-9-12(7-15(20)22-2)18-11-5-4-10(17)6-14(11)19-13(9)8-16(21)23-3/h4-9,18-19H,1-3H3/b12-7-,13-8-
InChIKey RLCMDEPVEQJNIP-AJDRMPRJSA-N
Mol Weight 381.23 g/mol
Molecular Formula C16H17BrN2O4
Exact Mass 380.03717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yBjkdXHWNK
Name (2Z,2'Z)-Dimethyl 2,2'-(7-bromo-3-methyl-1H-benzo[b][1,4]diazepine-2,4(3H,5H)-diylidene)diacetate
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Formula C16H17BrN2O4
InChI InChI=1S/C16H17BrN2O4/c1-9-12(7-15(20)22-2)18-11-5-4-10(17)6-14(11)19-13(9)8-16(21)23-3/h4-9,18-19H,1-3H3/b12-7-,13-8-
InChIKey RLCMDEPVEQJNIP-AJDRMPRJSA-N
Molecular Weight 381.226 g/mol
SMILES N1\C(C(\C(Nc2c1ccc(c2)Br)=C/C(=O)OC)C)=C/C(=O)OC
SPLASH splash10-001i-2049000000-6fa0c49fefa490b61786
Source of Spectrum F-68-6460-9k
Wiley ID 1717293