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6,7-dimethyl heptacyclo[10.6.1.1(4,9).0(2,11).0(3,10).0(5,8).0(13,18)]icosa-6,13(18),14,16-tetraene-6,7-dicarboxylate
SpectraBase Compound ID FfyISqvnSIP
InChI InChI=1S/C24H24O4/c1-27-23(25)21-19-13-8-14(20(19)22(21)24(26)28-2)18-16-12-7-11(15(16)17(13)18)9-5-3-4-6-10(9)12/h3-6,11-20H,7-8H2,1-2H3/t11-,12+,13-,14+,15-,16-,17?,18?,19-,20+/m1/s1
InChIKey WTOLGUWQLKQDJT-KAMZVWDOSA-N
Mol Weight 376.45 g/mol
Molecular Formula C24H24O4
Exact Mass 376.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uAn7ZUxpQ
Name 6,7-dimethyl heptacyclo[10.6.1.1(4,9).0(2,11).0(3,10).0(5,8).0(13,18)]icosa-6,13(18),14,16-tetraene-6,7-dicarboxylate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24O4
InChI InChI=1S/C24H24O4/c1-27-23(25)21-19-13-8-14(20(19)22(21)24(26)28-2)18-16-12-7-11(15(16)17(13)18)9-5-3-4-6-10(9)12/h3-6,11-20H,7-8H2,1-2H3/t11-,12+,13-,14+,15-,16-,17?,18?,19-,20+/m1/s1
InChIKey WTOLGUWQLKQDJT-KAMZVWDOSA-N
Instrument Name VG70-250S
Ionization Type EI
Literature Reference DOI 10.1002/jccs.202100205
Molecular Weight 376.452 g/mol
SMILES c12[C@]3(C[C@@](c2cccc1)([C@@]1([C@@]3(C2[C@]3(C[C@]([C@]4([C@@]3(C(=C4C(=O)OC)C(OC)=O)[H])[H])(C12)[H])[H])[H])[H])[H])[H]
SPLASH splash10-016u-0839000000-000dd5f0e3d3c5743be4
Source of Spectrum QA-68-2218-NB3
Wiley ID 1871880