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Sclarene
SpectraBase Compound ID FauY2IwcVUk
InChI InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m1/s1
InChIKey KYLKKZSVPLUGCC-GGPKGHCWSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNXUIAVqRvb
Name Naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-pentenyl)-, [4aS-(4a..alpha..,5..alpha..,8a..beta..)]-
Carrier Gas Helium (54.1 mL/min)
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Exact Mass 272.250401030 u
Formula C20H32
GC Column SH-Rxi-5silMS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m1/s1
InChIKey KYLKKZSVPLUGCC-GGPKGHCWSA-N
Inlet Type Split ratio (50:05)
Instrument Name Shimadzu TQ8050 plus
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300332
Molecular Weight 272.476 g/mol
Quality 830
SMILES C1C[C@@]2([C@@](C(C1)(C)C)(CCC([C@]2(CCC(C=C)=C)[H])=C)[H])C
SPLASH splash10-0a4i-7960000000-3ed2cf0712d353d17dff
Source of Spectrum CBD-20-SM12-12-6 (DOI: 10.1002/cbdv.202300332)
Wiley ID 1909905