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(+)-Asterisca-1,6,8-triene
SpectraBase Compound ID 7qfC9QUWgLm
InChI InChI=1S/C15H22/c1-11-6-5-7-12(2)14-10-15(3,4)9-13(14)8-11/h6,8,10,12H,5,7,9H2,1-4H3/b11-6-,13-8-/t12-/m0/s1
InChIKey IVQBGBKEAYJKLK-IVMZOLBLSA-N
Mol Weight 202.34 g/mol
Molecular Formula C15H22
Exact Mass 202.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4XMylLccv4
Name (+)-Asterisca-1,6,8-triene
Carrier Gas Helium (23.3 mL/min or 1 mL/min)
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Exact Mass 202.172150708 u
Formula C15H22
GC Column HP5-MS or CP-ChiraSil-DEX CB column (30 m x 0.25 mm or 25 m x 0.25 mm, film thickness 0.50 micrometer or 0.36 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C15H22/c1-11-6-5-7-12(2)14-10-15(3,4)9-13(14)8-11/h6,8,10,12H,5,7,9H2,1-4H3/b11-6-,13-8-/t12-/m0/s1
InChIKey IVQBGBKEAYJKLK-IVMZOLBLSA-N
Inlet Type Split (10:1)
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201608971
Molecular Weight 202.341 g/mol
Optical Rotation [a]D21 = +260.0 (c = 0.067, (2H6)benzene)
Quality 493
Reported Formula C15H22
SMILES C=12\C(=C/C(=C\CC[C@@]2(C)[H])C)CC(C1)(C)C
SPLASH splash10-052k-1910000000-6a1822d3e7231f6930b4
Source of Spectrum ACI-55-SM4-10 (DOI: 10.1002/anie.201608971)
Wiley ID 1902798