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anti-8-methyl[2.2](1,4)naphthalenometacyclohane
SpectraBase Compound ID 5E7mBjEc0Cf
InChI InChI=1S/C21H20/c1-15-4-2-7-20-18-10-8-16-5-3-6-17(14-16)9-11-19(13-12-18)21(15)20/h2-7,12-14H,8-11H2,1H3
InChIKey LUFKVSGYCJTJJZ-UHFFFAOYSA-N
Mol Weight 272.39 g/mol
Molecular Formula C21H20
Exact Mass 272.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChEj36NKRj
Name anti-8-methyl[2.2](1,4)naphthalenometacyclohane
CAS Registry Number 123487-53-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20
InChI InChI=1S/C21H20/c1-15-4-2-7-20-18-10-8-16-5-3-6-17(14-16)9-11-19(13-12-18)21(15)20/h2-7,12-14H,8-11H2,1H3
InChIKey LUFKVSGYCJTJJZ-UHFFFAOYSA-N
Molecular Weight 272.391 g/mol
SMILES c12c(c3CCc4cccc(c4)CCc1cc3)cccc2C
SPLASH splash10-01b9-0690000000-39a2eea4e3597e26cc1b
Source of Spectrum J-54-5994-0
Synonyms 13-Methyltetracyclo[9.6.2.1(4,8).0(12,17)]icosa-1(18),4(20),5,7,11(19),12,14,16-octaene
Wiley ID 1276900