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Dimethyl 4-(2'-phthalomido-3'-methoxy-3'-oxopropyl)-4-nitro-2,6-diphthalimidoheptane-1,7-dioate
SpectraBase Compound ID 8Lhhz0Z5YEb
InChI InChI=1S/C37H30N4O14/c1-53-34(48)25(38-28(42)19-10-4-5-11-20(19)29(38)43)16-37(41(51)52,17-26(35(49)54-2)39-30(44)21-12-6-7-13-22(21)31(39)45)18-27(36(50)55-3)40-32(46)23-14-8-9-15-24(23)33(40)47/h4-15,25-27H,16-18H2,1-3H3
InChIKey XSESRQINJOAALH-UHFFFAOYSA-N
Mol Weight 754.7 g/mol
Molecular Formula C37H30N4O14
Exact Mass 754.175852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ecRvGrQIq8
Name Dimethyl 4-(2'-phthalomido-3'-methoxy-3'-oxopropyl)-4-nitro-2,6-diphthalimidoheptane-1,7-dioate
Alternate Name(s) 2,6-bis(1,3-dioxo-2-isoindolyl)-4-[2-(1,3-dioxo-2-isoindolyl)-3-methoxy-3-oxopropyl]-4-nitroheptanedioic acid dimethyl ester Dimethyl 2,6-bis(1,3-dioxoisoindol-2-yl)-4-[2-(1,3-dioxoisoindol-2-yl)-3-methoxy-3-oxopropyl]-4-nitroheptanedioate Dimethyl 2,6-bis(1,3-dioxoisoindolin-2-yl)-4-[2-(1,3-dioxoisoindolin-2-yl)-3-methoxy-3-oxo-propyl]-4-nitro-heptanedioate Dimethyl 2,6-bis[1,3-bis(oxidanylidene)isoindol-2-yl]-4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methoxy-3-oxidanylidene-propyl]-4-nitro-heptanedioate
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Formula C37H30N4O14
InChI InChI=1S/C37H30N4O14/c1-53-34(48)25(38-28(42)19-10-4-5-11-20(19)29(38)43)16-37(41(51)52,17-26(35(49)54-2)39-30(44)21-12-6-7-13-22(21)31(39)45)18-27(36(50)55-3)40-32(46)23-14-8-9-15-24(23)33(40)47/h4-15,25-27H,16-18H2,1-3H3
InChIKey XSESRQINJOAALH-UHFFFAOYSA-N
Molecular Weight 754.661 g/mol
SMILES C1(N(C(c2ccccc12)=O)C(CC(N(=O)=O)(CC(N1C(c2ccccc2C1=O)=O)C(=O)OC)CC(N1C(c2ccccc2C1=O)=O)C(=O)OC)C(=O)OC)=O
SPLASH splash10-0udi-0900002100-7dacc38e18b7ef4ea36e
Source of Spectrum KC-0-1118-10
Wiley ID 824674