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(+)-(S)-6,6-DIMETHYLBICYClO-[3.3.1]-HEPT-2-ENE-2-ACETIC-ACID
SpectraBase Compound ID DqwNDQffDXs
InChI InChI=1S/C11H16O2/c1-11(2)8-4-3-7(5-10(12)13)9(11)6-8/h3,8-9H,4-6H2,1-2H3,(H,12,13)/t8-,9-/m1/s1
InChIKey WMYLCTIMJOAUDL-RKDXNWHRSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jjy0bP8mss5
Name (1S)-6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-acetic acid
Alternate Name(s) ((1S,5R)-6,6-Dimethyl-bicyclo[3.1.1]hept-2-en-2-yl)-acetic acid [(1S)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl]acetic acid 2-[(1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]ethanoic acid
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Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-11(2)8-4-3-7(5-10(12)13)9(11)6-8/h3,8-9H,4-6H2,1-2H3,(H,12,13)/t8-,9-/m1/s1
InChIKey WMYLCTIMJOAUDL-RKDXNWHRSA-N
Molecular Weight 180.247 g/mol
SMILES OC(CC=1[C@@]2(C([C@@](C2)(CC1)[H])(C)C)[H])=O
SPLASH splash10-0006-9400000000-b14c075221d3a01f9618
Source of Spectrum H-76-542-7
Wiley ID 1176633