Dataset

2-Propenoic acid, (octahydro-4,7-methano-1H-indene-5 - diyl)bis(methyleneiminocarbonyloxy-2,1-ethanediyl) ester; LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+H]+

This MassBank record with Accession MSBNK-Antwerp_Univ-AN123402 contains the MS2 mass spectrum of 2-Propenoic acid, (octahydro-4,7-methano-1H-indene-5 - diyl)bis(methyleneiminocarbonyloxy-2,1-ethanediyl) ester with the InChIkey WNYXLVFCZZCCLX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H34N2O8/c1-3-20(27)31-7-9-33-23(29)25-13-15-5-6-18-16-11-17(19(12-16)22(15)18)14-26-24(30)34-10-8-32-21(28)4-2/h3-4,15-19,22H,1-2,5-14H2,(H,25,29)(H,26,30)
SMILES C=CC(=O)OCCOC(=O)NCC1CCC2C3CC(CNC(=O)OCCOC(=O)C=C)C(C3)C12
InChI Key WNYXLVFCZZCCLX-UHFFFAOYSA-N
Molecular Formula C24H34N2O8
Exact Mass 478.231 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN123402
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MetadataPublished 2021-08-17
Related Molecule
  • 2-[[9-[(2-prop-2-enoyloxyethoxycarbonylamino)methyl]-3-tricyclo[5.2.1.02,6]decanyl]methylcarbamoyloxy]ethyl prop-2-enoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    162420305 PubChem
    The data in this table is sourced from UniChem at EBI.