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Guaiene<trans-beta->
SpectraBase Compound ID 23vAz4qqnBj
InChI InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3/t11-,12+/m0/s1
InChIKey GIBQERSGRNPMEH-NWDGAFQWSA-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 NioAcyyShx
Name trans-.beta.-Guaiene
Alternate Name(s) Guaiene
CAS Registry Number 53863-54-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3/t11-,12+/m0/s1
InChIKey GIBQERSGRNPMEH-NWDGAFQWSA-N
Molecular Weight 204.357 g/mol
SMILES C1[C@@](C2=C(CC(C1)=C(C)C)[C@@](CC2)(C)[H])(C)[H]
SPLASH splash10-052f-7900000000-65ce1fec40a082de60a2
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886388