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6-Adamantan-2-ylidene-3-(4-tert-butylphenyl)-6,6a-dihydro-3aH-cyclopenta[d]isoxazole
SpectraBase Compound ID gZnJKlmonp
InChI InChI=1S/C26H31NO/c1-26(2,3)20-6-4-17(5-7-20)24-22-9-8-21(25(22)28-27-24)23-18-11-15-10-16(13-18)14-19(23)12-15/h4-9,15-16,18-19,22,25H,10-14H2,1-3H3/b23-21-/t15-,16+,18-,19+,22?,25?
InChIKey YRLANXNBYMFOBU-PKSWRELNSA-N
Mol Weight 373.54 g/mol
Molecular Formula C26H31NO
Exact Mass 373.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbNJsqlRZ9j
Name 6-Adamantan-2-ylidene-3-(4-tert-butylphenyl)-6,6a-dihydro-3aH-cyclopenta[d]isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO
InChI InChI=1S/C26H31NO/c1-26(2,3)20-6-4-17(5-7-20)24-22-9-8-21(25(22)28-27-24)23-18-11-15-10-16(13-18)14-19(23)12-15/h4-9,15-16,18-19,22,25H,10-14H2,1-3H3/b23-21-/t15-,16+,18-,19+,22?,25?
InChIKey YRLANXNBYMFOBU-PKSWRELNSA-N
Molecular Weight 373.540 g/mol
SMILES C1(=NOC2C1C=CC2=C1[C@]2(C[C@@]3(C[C@@](C[C@]1(C3)[H])(C2)[H])[H])[H])c1ccc(cc1)C(C)(C)C
SPLASH splash10-0592-1918000000-a07af3c0e7df5c32870c
Source of Spectrum F-62-7386-3
Synonyms 3-(4-tert-butylphenyl)-6-tricyclo[3.3.1.1(3,7)]dec-2-ylidene-6,6a-dihydro-3aH-cyclopenta[d]isoxazole
Wiley ID 1640210