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21,22-Dimethoxydecacyclo[14.10.1,1(4,13).1(7,10).0(2,15).0(3,14).0(5,12).0(6,11).0(17,26).0(19,24)]hexacosa-8,17,19,21,23,25-hexene

View entire compound with spectra: 1 MS (GC)

21,22-Dimethoxydecacyclo[14.10.1,1(4,13).1(7,10).0(2,15).0(3,14).0(5,12).0(6,11).0(17,26).0(19,24)]hexacosa-8,17,19,21,23,25-hexene
SpectraBase Compound ID HVkXS3ksYMN
InChI InChI=1S/C31H32O2/c1-32-22-8-14-6-16-17(7-15(14)9-23(22)33-2)19-10-18(16)26-27(19)31-21-11-20(30(26)31)28-24-12-3-4-13(5-12)25(24)29(21)28/h3-4,6-9,12-13,18-21,24-31H,5,10-11H2,1-2H3/t12-,13+,18-,19+,20+,21-,24+,25?,26-,27?,28?,29?,30?,31+/m0/s1
InChIKey ZRKPKAFHBBGAEJ-RTVDRGMGSA-N
Mol Weight 436.6 g/mol
Molecular Formula C31H32O2
Exact Mass 436.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9fVeX93yEO
Name 21,22-Dimethoxydecacyclo[14.10.1,1(4,13).1(7,10).0(2,15).0(3,14).0(5,12).0(6,11).0(17,26).0(19,24)]hexacosa-8,17,19,21,23,25-hexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32O2
InChI InChI=1S/C31H32O2/c1-32-22-8-14-6-16-17(7-15(14)9-23(22)33-2)19-10-18(16)26-27(19)31-21-11-20(30(26)31)28-24-12-3-4-13(5-12)25(24)29(21)28/h3-4,6-9,12-13,18-21,24-31H,5,10-11H2,1-2H3/t12-,13+,18-,19+,20+,21-,24+,25?,26-,27?,28?,29?,30?,31+/m0/s1
InChIKey ZRKPKAFHBBGAEJ-RTVDRGMGSA-N
Molecular Weight 436.595 g/mol
SMILES C12[C@]([C@]3(C[C@@]2(c2c3cc3cc(OC)c(cc3c2)OC)[H])[H])(C2[C@@]1([C@@]1(C3C([C@]2(C1)[H])[C@]1(C3[C@@]2(C=C[C@]1(C2)[H])[H])[H])[H])[H])[H]
SPLASH splash10-000i-0020900000-bd8a8d930f89b783f2d7
Source of Spectrum KC-61-6973-6
Wiley ID 1629865