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3,5-OCTADIYNE-1,8-DIYL_BIS-N-(4-NITROPHENYL)-CARBAMATE
SpectraBase Compound ID OZbis65Bq2
InChI InChI=1S/C22H18N4O8/c27-21(23-17-7-11-19(12-8-17)25(29)30)33-15-5-3-1-2-4-6-16-34-22(28)24-18-9-13-20(14-10-18)26(31)32/h7-14H,5-6,15-16H2,(H,23,27)(H,24,28)
InChIKey MHJWRPMXBLWQNS-UHFFFAOYSA-N
Mol Weight 466.41 g/mol
Molecular Formula C22H18N4O8
Exact Mass 466.112464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID P8q5Hlewbx
Name 3,5-OCTADIYNE-1,8-DIYL_BIS-N-(4-NITROPHENYL)-CARBAMATE
Compound Number IIC
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18N4O8
InChI InChI=1S/C22H18N4O8/c27-21(23-17-7-11-19(12-8-17)25(29)30)33-15-5-3-1-2-4-6-16-34-22(28)24-18-9-13-20(14-10-18)26(31)32/h7-14H,5-6,15-16H2,(H,23,27)(H,24,28)
InChIKey MHJWRPMXBLWQNS-UHFFFAOYSA-N
Literature Reference Author S.Y.VYAZMIN,S.E.BEREZINA,L.A.REMIZOVA,I.N.DOMNIN,R.GLEITER
Literature Reference Citation RUSS.J.ORG.CHEM.,38,775(2002)
Literature Reference DOI 10.1023/A:1020326818084
Molecular Weight 466.407 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ10548