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1-Cyclopentene-1-carboxylic acid, 2-[(3-bromo-1-oxo-2-propenyl)(phenylmethyl)amino]-, ethyl ester, (Z)-
SpectraBase Compound ID IcM3kv00pG0
InChI InChI=1S/C18H20BrNO3/c1-2-23-18(22)15-9-6-10-16(15)20(17(21)11-12-19)13-14-7-4-3-5-8-14/h3-5,7-8,11-12H,2,6,9-10,13H2,1H3/b12-11+
InChIKey UKIATZINSPSQHM-VAWYXSNFSA-N
Mol Weight 378.27 g/mol
Molecular Formula C18H20BrNO3
Exact Mass 377.062657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xMIEWjT4sU
Name 1-Cyclopentene-1-carboxylic acid, 2-[(3-bromo-1-oxo-2-propenyl)(phenylmethyl)amino]-, ethyl ester, (Z)-
CAS Registry Number 124985-27-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20BrNO3
InChI InChI=1S/C18H20BrNO3/c1-2-23-18(22)15-9-6-10-16(15)20(17(21)11-12-19)13-14-7-4-3-5-8-14/h3-5,7-8,11-12H,2,6,9-10,13H2,1H3/b12-11+
InChIKey UKIATZINSPSQHM-VAWYXSNFSA-N
Molecular Weight 378.266 g/mol
SMILES C1(=C(N(C(\C=C\Br)=O)Cc2ccccc2)CCC1)C(=O)OCC
SPLASH splash10-006x-9052000000-b7fc5525bbc30128b665
Source of Spectrum F-45-3563-4
Synonyms Ethyl 2-{benzyl[(2E)-3-bromo-2-propenoyl]amino}-1-cyclopentene-1-carboxylate N-Benzyl-N-(2-carboethoxycyclopent-1-enyl)-z-3-bromoacrylamide
Wiley ID 1358212