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Methyl exo-8-hydroxypentacyclo[5.4.0.0(2,6).0(3,10).0(5,9)]undecane-9-carboxylate
SpectraBase Compound ID L0EKjxOyUVB
InChI InChI=1S/C13H16O3/c1-16-12(15)13-6-3-5-8-4(6)2-7(13)10(8)9(5)11(13)14/h4-11,14H,2-3H2,1H3/t4?,5?,6?,7?,8?,9?,10?,11-,13+/m1/s1
InChIKey GUOVCLBSNFFZPZ-KVCWPSPRSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46uvdubbqhJ
Name Methyl exo-8-hydroxypentacyclo[5.4.0.0(2,6).0(3,10).0(5,9)]undecane-9-carboxylate
Alternate Name(s) Methyl 8-hydroxypentacyclo[5.4.0.0(2,6).0(3,10).0(5,9)]undecane-9-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-16-12(15)13-6-3-5-8-4(6)2-7(13)10(8)9(5)11(13)14/h4-11,14H,2-3H2,1H3/t4?,5?,6?,7?,8?,9?,10?,11-,13+/m1/s1
InChIKey GUOVCLBSNFFZPZ-KVCWPSPRSA-N
Molecular Weight 220.268 g/mol
SMILES O[C@@]1(C2C3CC4[C@@]1(C1C2C3C4C1)C(=O)OC)[H]
SPLASH splash10-0w2i-0950000000-37aa72df39505b0dfa95
Source of Spectrum KC-0-1834-8
Wiley ID 821349