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3-Chlorobicyclo[3.2.1]oct-2-ene-6,4-carbolactone
SpectraBase Compound ID EgNPH0I14GZ
InChI InChI=1S/C9H9ClO2/c10-7-3-4-1-5-6(2-4)9(11)12-8(5)7/h3-6,8H,1-2H2/t4-,5+,6-,8-/m0/s1
InChIKey IQSOENQTLMYGNW-GCJQMDKQSA-N
Mol Weight 184.62 g/mol
Molecular Formula C9H9ClO2
Exact Mass 184.029107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5nCXylyCLr
Name 3-Chlorobicyclo[3.2.1]oct-2-ene-6,4-carbolactone
Alternate Name(s) 7-Chloro-3a,4,5,7a-tetrahydro-3,5-methanobenzofuran-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClO2
InChI InChI=1S/C9H9ClO2/c10-7-3-4-1-5-6(2-4)9(11)12-8(5)7/h3-6,8H,1-2H2/t4-,5+,6-,8-/m0/s1
InChIKey IQSOENQTLMYGNW-GCJQMDKQSA-N
Literature Reference DOI 10.1002/hlca.19850680519
Molecular Weight 184.622 g/mol
SMILES [C@]12([C@]3(C(=C[C@](C[C@@]2(C(O3)=O)[H])(C1)[H])Cl)[H])[H]
SPLASH splash10-0a4i-2900000000-04c5c81a0f8e9d9c1c89
Source of Spectrum H-68-1232-12
Wiley ID 1794888