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1H,4H-3a,6a-[2]Butenopyrrolo[3,4-c]pyrrole-1,3,4,6(2H,5H)-tetrone, 2,5-di-2-propynyl-
SpectraBase Compound ID 5nTUKgJxx8O
InChI InChI=1S/C16H12N2O4/c1-3-9-17-11(19)15-7-5-6-8-16(15,12(17)20)14(22)18(10-4-2)13(15)21/h1-2,5-6H,7-10H2
InChIKey ZFEXPTQPYBWQSI-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C16H12N2O4
Exact Mass 296.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATmxUB0H8RS
Name 1H,4H-3a,6a-[2]Butenopyrrolo[3,4-c]pyrrole-1,3,4,6(2H,5H)-tetrone, 2,5-di-2-propynyl-
Alternate Name(s) 8,11-bis(prop-2-yn-1-yl)-8,11-diazatricyclo[4.3.3.0(1,6)]dodec-3-ene-7,9,10,12-tetrone N,N'-di(2-propyn-1-yl)[4.3.3]propellene-bis-imide
CAS Registry Number 94767-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O4
InChI InChI=1S/C16H12N2O4/c1-3-9-17-11(19)15-7-5-6-8-16(15,12(17)20)14(22)18(10-4-2)13(15)21/h1-2,5-6H,7-10H2
InChIKey ZFEXPTQPYBWQSI-UHFFFAOYSA-N
Molecular Weight 296.282 g/mol
SMILES C123C(C(=O)N(C3=O)CC#C)(C(=O)N(C1=O)CC#C)CC=CC2
SPLASH splash10-000b-0490000000-d06f4a11c577bef9ef46
Source of Spectrum F-40-3329-0
Wiley ID 1298953