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Dimethyl 3-[2'-cyclopropyl-1'-(3"-nitrophenyl)ethenyl]cyclohex-4-ene-1,2-dicarboxylate
SpectraBase Compound ID 49NkNhRLB1n
InChI InChI=1S/C21H23NO6/c1-27-20(23)17-8-4-7-16(19(17)21(24)28-2)18(11-13-9-10-13)14-5-3-6-15(12-14)22(25)26/h3-7,11-13,16-17,19H,8-10H2,1-2H3/b18-11+
InChIKey AGYJRHOOTWXZCO-WOJGMQOQSA-N
Mol Weight 385.42 g/mol
Molecular Formula C21H23NO6
Exact Mass 385.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaHLwDg3xhi
Name Dimethyl 3-[2'-cyclopropyl-1'-(3"-nitrophenyl)ethenyl]cyclohex-4-ene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO6
InChI InChI=1S/C21H23NO6/c1-27-20(23)17-8-4-7-16(19(17)21(24)28-2)18(11-13-9-10-13)14-5-3-6-15(12-14)22(25)26/h3-7,11-13,16-17,19H,8-10H2,1-2H3/b18-11+
InChIKey AGYJRHOOTWXZCO-WOJGMQOQSA-N
Molecular Weight 385.416 g/mol
SMILES C1(\C(=C\C2CC2)c2cc(N(=O)=O)ccc2)C(C(C(=O)OC)CC=C1)C(=O)OC
SPLASH splash10-014j-5759000000-616399eacb2d34918b5f
Source of Spectrum ES-2005-2262-8
Synonyms Dimethyl 3-[(Z)-2-cyclopropyl-1-(3-nitrophenyl)ethenyl]-4-cyclohexene-1,2-dicarboxylate
Wiley ID 1563428