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9-Hydroxy-2-oxatricyclo[4.2.1.0(4,8)]nonane-2-carboxylic acid
SpectraBase Compound ID DWKSTMHPur9
InChI InChI=1S/C9H12O4/c10-7-4-1-3-5(2-13-8(3)7)6(4)9(11)12/h3-8,10H,1-2H2,(H,11,12)/t3-,4+,5-,6+,7+,8+/m1/s1
InChIKey XTAZZFTWHGPQKB-KNRMECKQSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpyWJ4H8X9e
Name 9-Hydroxy-2-oxatricyclo[4.2.1.0(4,8)]nonane-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c10-7-4-1-3-5(2-13-8(3)7)6(4)9(11)12/h3-8,10H,1-2H2,(H,11,12)/t3-,4+,5-,6+,7+,8+/m1/s1
InChIKey XTAZZFTWHGPQKB-KNRMECKQSA-N
Molecular Weight 184.191 g/mol
SMILES OC([C@@]1([C@]2([C@@]3([C@@]([C@]([C@]1(C3)[H])(O)[H])(OC2)[H])[H])[H])[H])=O
SPLASH splash10-014i-0900000000-6f86da245b1925092ba1
Source of Spectrum D8-325-584-5
Synonyms 2-Hydroxy-4-oxatricyclo[4.2.1.0(3,7)]nonane-9-carboxylic acid
Wiley ID 1514496