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Sesquithujene
SpectraBase Compound ID Gm6fNGEaBQi
InChI InChI=1S/C15H24/c1-11(2)6-5-7-13(4)15-9-8-12(3)14(15)10-15/h6,8,13-14H,5,7,9-10H2,1-4H3/t13-,14-,15-/m1/s1
InChIKey UCQHFDKBUHCAFR-RBSFLKMASA-N
Mol Weight 204.36 g/mol
Molecular Formula C15H24
Exact Mass 204.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FQ9ZvQITI
Name Sesquithujene
CAS Registry Number 58319-06-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24
InChI InChI=1S/C15H24/c1-11(2)6-5-7-13(4)15-9-8-12(3)14(15)10-15/h6,8,13-14H,5,7,9-10H2,1-4H3/t13-,14-,15-/m1/s1
InChIKey UCQHFDKBUHCAFR-RBSFLKMASA-N
Molecular Weight 204.357 g/mol
SMILES [C@@]12([C@@](C(C)=CC2)(C1)[H])[C@@](CCC=C(C)C)(C)[H]
SPLASH splash10-014l-9500000000-82b121e1ce2a3bf21f1a
Source of Spectrum QE-14-9189-9
Synonyms (5R)-4-methyl-1-[(2R)-6-methylhept-5-en-2-yl]bicyclo[3.1.0]hex-3-ene
Wiley ID 1692423