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Dimethyl 13-anti-18-anti-dibromononacyclo[12.6.0.0(2,6).0(4,11).0(5,9).0(7,20).0(10,17).0(12,16).0(15.19)]icosa-1(20),10-dien-3-anti-,8-anti-dicarboxylate
SpectraBase Compound ID 5aBNH7CAiUK
InChI InChI=1S/C24H22Br2O4/c1-29-23(27)19-9-3-4-10(19)6-8-12(4)20(24(28)30-2)11(3)7-5(9)15-13-14(16(6)21(15)25)18(8)22(26)17(7)13/h3-4,9-22H,1-2H3
InChIKey CTAOOVNGACMGJI-UHFFFAOYSA-N
Mol Weight 534.24 g/mol
Molecular Formula C24H22Br2O4
Exact Mass 531.988485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76q6fDMMrJZ
Name Dimethyl 13-anti-18-anti-dibromononacyclo[12.6.0.0(2,6).0(4,11).0(5,9).0(7,20).0(10,17).0(12,16).0(15.19)]icosa-1(20),10-dien-3-anti-,8-anti-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22Br2O4
InChI InChI=1S/C24H22Br2O4/c1-29-23(27)19-9-3-4-10(19)6-8-12(4)20(24(28)30-2)11(3)7-5(9)15-13-14(16(6)21(15)25)18(8)22(26)17(7)13/h3-4,9-22H,1-2H3
InChIKey CTAOOVNGACMGJI-UHFFFAOYSA-N
Molecular Weight 534.244 g/mol
SMILES C12=C3C4C(C(=O)OC)C5C6C4C2C(C6C=2C4C(C1C1C4C(C(C31)Br)C52)Br)C(=O)OC
SPLASH splash10-0ug0-0790140000-d7fa3381559252bac417
Source of Spectrum C-115-7188-21
Synonyms Dimethyl 13-anti,18-anti-Dibromononacyclo[12.6.0.0(2,6).0(4,11).0(5,9).0(7,20).0(10,17).0(12,16).0(15,19)]icosa-1(20),10-diene-3-syn,8,syn-dicarboxylate Dimethyl 13,18-dibromononacyclo[12.6.0.0(2,6).0(4,11).0(5,9).0(7,20).0(10,17).0(12,16).0(15,19)]icosa-1(20),10-diene-3,8-dicarboxylate
Wiley ID 1403551