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exo-7-(Hydroxymethyl)-endo-7-carboxynorcarane
SpectraBase Compound ID B0SelbZLuQt
InChI InChI=1S/C9H14O3/c10-5-9(8(11)12)6-3-1-2-4-7(6)9/h6-7,10H,1-5H2,(H,11,12)
InChIKey MDYPRPVHUMWAGN-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ghK7xp0Cf2
Name exo-7-(Hydroxymethyl)-endo-7-carboxynorcarane
Alternate Name(s) 7-(hydroxymethyl)bicyclo[4.1.0]heptane-7-carboxylic acid
CAS Registry Number 68630-29-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c10-5-9(8(11)12)6-3-1-2-4-7(6)9/h6-7,10H,1-5H2,(H,11,12)
InChIKey MDYPRPVHUMWAGN-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES OC(C1(CO)C2CCCCC12)=O
SPLASH splash10-1090-6900000000-6987c89e4c2d7ca2b012
Source of Spectrum J-44-790-0
Wiley ID 1166566