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Bicyclo[4.1.0]hept-2-ene-7-carboxylic acid, 7-(hydroxymethyl)-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-
SpectraBase Compound ID IIk4NoBZH0X
InChI InChI=1S/C10H14O3/c1-13-9(12)10(6-11)7-4-2-3-5-8(7)10/h2,4,7-8,11H,3,5-6H2,1H3/t7-,8+,10-/m0/s1
InChIKey HITSMCZNTVJTQG-XKSSXDPKSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZCbjmGH833
Name Bicyclo[4.1.0]hept-2-ene-7-carboxylic acid, 7-(hydroxymethyl)-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-
CAS Registry Number 68582-72-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-13-9(12)10(6-11)7-4-2-3-5-8(7)10/h2,4,7-8,11H,3,5-6H2,1H3/t7-,8+,10-/m0/s1
InChIKey HITSMCZNTVJTQG-XKSSXDPKSA-N
Molecular Weight 182.219 g/mol
SMILES OC[C@@]1([C@]2(C=CCC[C@@]12[H])[H])C(=O)OC
SPLASH splash10-0ke9-8900000000-f8f2d0d34fad22dcc448
Source of Spectrum J-44-792-0
Synonyms exo-7-(hydroxymethyl)-endo-7-(carbomethoxy)-2-norcarene Methyl (1S,6R,7R)-7-(hydroxymethyl)bicyclo[4.1.0]hept-2-ene-7-carboxylate
Wiley ID 1178423