(+/-)-(1R*,2R*,6R*,7S*)-7-HYDROXY-4-OXO-BICYCLO-[4.3.0]-NON-2-YL-CARBOXYLIC-ACID - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	3AxTyIjgvN8
InChI	InChI=1S/C10H14O4/c11-5-3-7-6(1-2-9(7)12)8(4-5)10(13)14/h6-9,12H,1-4H2,(H,13,14)/t6-,7-,8-,9+/m1/s1
InChIKey	XUMQUJRLIUICBV-BGZDPUMWSA-N Google Search
Mol Weight	198.22 g/mol
Molecular Formula	C10H14O4
Exact Mass	198.089209 g/mol

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SpectraBase Spectrum ID	DAadyt1Hvc0
Name	(1S,3aR,4R,7aR)-1-hydroxy-6-keto-1,2,3,3a,4,5,7,7a-octahydroindene-4-carboxylic acid
Alternate Name(s)	(1S,3aR,4R,7aR)-1-hydroxy-6-oxo-1,2,3,3a,4,5,7,7a-octahydroindene-4-carboxylic acid (1S,3aR,4R,7aR)-1-oxidanyl-6-oxidanylidene-1,2,3,3a,4,5,7,7a-octahydroindene-4-carboxylic acid
CAS Registry Number	123559-45-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C10H14O4
InChI	InChI=1S/C10H14O4/c11-5-3-7-6(1-2-9(7)12)8(4-5)10(13)14/h6-9,12H,1-4H2,(H,13,14)/t6-,7-,8-,9+/m1/s1
InChIKey	XUMQUJRLIUICBV-BGZDPUMWSA-N
Molecular Weight	198.218 g/mol
SMILES	OC([C@]1([C@]2([C@]([C@](CC2)(O)[H])(CC(C1)=O)[H])[H])[H])=O
SPLASH	splash10-002f-4900000000-0c6faeafcd586c99c7e8
Source of Spectrum	F-45-1405-19
Wiley ID	1195231