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{(1S,4S,7R)-4,8,8-Trimethyl-2-methylenebicyclo[5.2.0]non-4-yl}methyl acetate (Birkenyl acetate)
SpectraBase Compound ID EBArL5rT8xX
InChI InChI=1S/C16H26O2/c1-11-8-16(5,10-18-12(2)17)7-6-14-13(11)9-15(14,3)4/h13-14H,1,6-10H2,2-5H3/t13-,14-,16+/m1/s1
InChIKey DQIYNENWJHGCCR-FMKPAKJESA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALiYQ5NZhYQ
Name {(1S,4S,7R)-4,8,8-Trimethyl-2-methylenebicyclo[5.2.0]non-4-yl}methyl acetate (Birkenyl acetate)
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Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-11-8-16(5,10-18-12(2)17)7-6-14-13(11)9-15(14,3)4/h13-14H,1,6-10H2,2-5H3/t13-,14-,16+/m1/s1
InChIKey DQIYNENWJHGCCR-FMKPAKJESA-N
Molecular Weight 250.382 g/mol
SMILES [C@@]12(C(C[C@](COC(=O)C)(C)CC[C@@]2([H])C(C1)(C)C)=C)[H]
SPLASH splash10-05mo-7900000000-9d04ec073ad01a58af26
Source of Spectrum K1-2004-2634-2
Synonyms [(1R,4S,7S)-4,9,9-trimethyl-6-methylidene-4-bicyclo[5.2.0]nonanyl]methyl acetate [(1R,4S,7S)-4,9,9-trimethyl-6-methylene-4-bicyclo[5.2.0]nonanyl]methyl acetate [(1R,4S,7S)-4,9,9-trimethyl-6-methylidene-4-bicyclo[5.2.0]nonanyl]methyl ethanoate
Wiley ID 1561031