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Benzoic acid, 4-(2,3,3a,4,7,7a-hexahydro-4,7-epoxy-1,3-dioxo-1H-isoindol-2-yl)-
SpectraBase Compound ID 2jsSkKFN1kp
InChI InChI=1S/C15H11NO5/c17-13-11-9-5-6-10(21-9)12(11)14(18)16(13)8-3-1-7(2-4-8)15(19)20/h1-6,9-12H,(H,19,20)
InChIKey XQMRTOHPXYYRQT-UHFFFAOYSA-N
Mol Weight 285.25 g/mol
Molecular Formula C15H11NO5
Exact Mass 285.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aUDaDnojbn
Name Benzoic acid, 4-(2,3,3a,4,7,7a-hexahydro-4,7-epoxy-1,3-dioxo-1H-isoindol-2-yl)-
Alternate Name(s) 4-(1,3-dioxo-3a,4,7,7a-tetrahydro-octahydro-1H-4,7-epoxyisoindol-2-yl)benzoic acid 4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydro-octahydro-1H-4,7-epoxyisoindol-2-yl]benzoic acid
CAS Registry Number 32620-96-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NO5
InChI InChI=1S/C15H11NO5/c17-13-11-9-5-6-10(21-9)12(11)14(18)16(13)8-3-1-7(2-4-8)15(19)20/h1-6,9-12H,(H,19,20)
InChIKey XQMRTOHPXYYRQT-UHFFFAOYSA-N
Molecular Weight 285.255 g/mol
SMILES OC(c1ccc(N2C(C3C4C=CC(C3C2=O)O4)=O)cc1)=O
SPLASH splash10-014i-9350000000-3ef91360bd49914c7c5d
Source of Spectrum AD-0-2532-0
Wiley ID 1431894