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(4Z,9Z)-14-(Ethoxycarbonyl)-8-[[(9-fluorenylmethoxy)carbonyl]oxy]-14-azabicyclo[8.3.1]tetradeca-4,9,11-triene-2,6-diyne
SpectraBase Compound ID HlohVzxS5e7
InChI InChI=1S/C31H25NO5/c1-2-35-30(33)32-22-12-5-3-4-6-15-24(20-23(32)14-11-13-22)37-31(34)36-21-29-27-18-9-7-16-25(27)26-17-8-10-19-28(26)29/h3-4,7-11,14,16-20,22,24,29H,2,13,21H2,1H3/b4-3-,23-20+/t22-,24+/m1/s1
InChIKey YZMMOQIUVMGTQH-ABZAMSRDSA-N
Mol Weight 491.54 g/mol
Molecular Formula C31H25NO5
Exact Mass 491.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8D9Dp6G1S4O
Name (4Z,9Z)-14-(Ethoxycarbonyl)-8-[[(9-fluorenylmethoxy)carbonyl]oxy]-14-azabicyclo[8.3.1]tetradeca-4,9,11-triene-2,6-diyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H25NO5
InChI InChI=1S/C31H25NO5/c1-2-35-30(33)32-22-12-5-3-4-6-15-24(20-23(32)14-11-13-22)37-31(34)36-21-29-27-18-9-7-16-25(27)26-17-8-10-19-28(26)29/h3-4,7-11,14,16-20,22,24,29H,2,13,21H2,1H3/b4-3-,23-20+/t22-,24+/m1/s1
InChIKey YZMMOQIUVMGTQH-ABZAMSRDSA-N
Molecular Weight 491.543 g/mol
SMILES C1=2N(C(=O)OCC)[C@](C#C\C=C/C#C[C@@](C2)(OC(OCC2c3c(cccc3)-c3c2cccc3)=O)[H])(CC=C1)[H]
SPLASH splash10-004i-0900000000-76db280c59a1653d251d
Source of Spectrum J-61-1374-18
Synonyms (4E,9Z)-(R)-14-(Ethoxycarbonyl)-8-[[(9-fluorenylmethoxy)carbonyl]oxy]-14-azabicyclo[8.3.1]tetradeca-4,9,11-triene-2,6-diyne Ethyl 3-{[(9H-fluoren-9-ylmethoxy)carbonyl]oxy}-14-azabicyclo[8.3.1]tetradeca-1,6,12-triene-4,8-diyne-14-carboxylate
Wiley ID 1397429