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Bicyclo[4.2.1]nona-2,4,7-triene, 7-butyl-
SpectraBase Compound ID 4ZOatrZmuCO
InChI InChI=1S/C13H18/c1-2-3-7-12-9-11-6-4-5-8-13(12)10-11/h4-6,8-9,11,13H,2-3,7,10H2,1H3/t11-,13-/m1/s1
InChIKey WZMDVJBXOAGNTA-DGCLKSJQSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lBtTuZVayv
Name Bicyclo[4.2.1]nona-2,4,7-triene, 7-butyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18
InChI InChI=1S/C13H18/c1-2-3-7-12-9-11-6-4-5-8-13(12)10-11/h4-6,8-9,11,13H,2-3,7,10H2,1H3/t11-,13-/m1/s1
InChIKey WZMDVJBXOAGNTA-DGCLKSJQSA-N
Molecular Weight 174.287 g/mol
SMILES C1[C@@]2(C(=C[C@]1(C=CC=C2)[H])CCCC)[H]
SPLASH splash10-014i-2900000000-37316b3882e95fc49d1b
Synonyms 7-Butylbicyclo[4.2.1]nona-2,4,7-triene
Wiley ID 1490709