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7-OXABICYCLO[2.2.1]HEPTANE-2,3-DICARBOXYLIC ACID (ACN)
SpectraBase Compound ID LjDfLaAl9vN
InChI InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6-/m0/s1
InChIKey GXEKYRXVRROBEV-FSIIMWSLSA-N
Mol Weight 186.16 g/mol
Molecular Formula C8H10O5
Exact Mass 186.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dRiXq8YwNm
Name ENDOTHAL
CAS Registry Number 145-73-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 186.052823417 u
Formula C8H10O5
InChI InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)/t3-,4+,5-,6-/m0/s1
InChIKey GXEKYRXVRROBEV-FSIIMWSLSA-N
Molecular Weight 186.163 g/mol
Nominal Mass 186 u
Number of Peaks 57
SMILES OC([C@]1([C@]2(CC[C@@]([C@@]1(C(=O)O)[H])(O2)[H])[H])[H])=O
SPLASH splash10-00kf-9400000000-d77a42019a8159d5e7b8
Source of Spectrum Dr. Rolf Kuehnle
Synonyms 7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
Technique DI/MS
Wiley ID WID_MSPA_3821