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2-Propenoic acid, 3-[4-[3-[[9-[[-3-[4-[-3-ethoxy-3-oxo-1-propen-1-yl]phenyl]-1-oxo-2-propen-1-yl]amino]nonyl]amino]-3-oxo-1-propen-1-yl]phenyl]-, ethyl ester
SpectraBase Compound ID 4sBkMQz9XRz
InChI InChI=1S/C37H46N2O6/c1-3-44-36(42)26-22-32-16-12-30(13-17-32)20-24-34(40)38-28-10-8-6-5-7-9-11-29-39-35(41)25-21-31-14-18-33(19-15-31)23-27-37(43)45-4-2/h12-27H,3-11,28-29H2,1-2H3,(H,38,40)(H,39,41)/b24-20-,25-21+,26-22+,27-23+
InChIKey OGWNZIHVJRLHHI-DZOZBGDOSA-N
Mol Weight 614.8 g/mol
Molecular Formula C37H46N2O6
Exact Mass 614.335587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNh0bNfbbSO
Name 2-Propenoic acid, 3-[4-[3-[[9-[[-3-[4-[-3-ethoxy-3-oxo-1-propen-1-yl]phenyl]-1-oxo-2-propen-1-yl]amino]nonyl]amino]-3-oxo-1-propen-1-yl]phenyl]-, ethyl ester
Alternate Name(s) (E)-ethyl 3-(4-((E)-3-((9-((Z)-3-(4-((E)-3-ethoxy-3-oxoprop-1-en-1-yl)phenyl)acrylamido)nonyl)amino)-3-oxoprop-1-en-1-yl)phenyl)acrylate (E)-3-[4-[(Z)-3-[9-[[(E)-3-[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl]-1-oxoprop-2-enyl]amino]nonylamino]-3-oxoprop-1-enyl]phenyl]-2-propenoic acid ethyl ester Ethyl (E)-3-[4-[(Z)-3-[9-[[(E)-3-[4-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]amino]nonylamino]-3-oxoprop-1-enyl]phenyl]prop-2-enoate Ethyl (E)-3-[4-[(Z)-3-[9-[[(E)-3-[4-[(E)-3-ethoxy-3-oxo-prop-1-enyl]phenyl]prop-2-enoyl]amino]nonylamino]-3-oxo-prop-1-enyl]phenyl]prop-2-enoate Ethyl (E)-3-[4-[(Z)-3-[9-[[(E)-3-[4-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoyl]amino]nonylamino]-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoate
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Formula C37H46N2O6
InChI InChI=1S/C37H46N2O6/c1-3-44-36(42)26-22-32-16-12-30(13-17-32)20-24-34(40)38-28-10-8-6-5-7-9-11-29-39-35(41)25-21-31-14-18-33(19-15-31)23-27-37(43)45-4-2/h12-27H,3-11,28-29H2,1-2H3,(H,38,40)(H,39,41)/b24-20-,25-21+,26-22+,27-23+
InChIKey OGWNZIHVJRLHHI-DZOZBGDOSA-N
Molecular Weight 614.783 g/mol
SMILES N(C(\C=C\c1ccc(\C=C\C(OCC)=O)cc1)=O)CCCCCCCCCNC(=O)\C=C/c1ccc(\C=C\C(=O)OCC)cc1
SPLASH splash10-004i-4972000000-99957a319ab166ead96e
Source of Spectrum JX-2015-4-1321
Wiley ID 1726710