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(BICYCLO-[2.2.1]-HEPT-5'-EN-2'-YLIDENE)-(1-13C)-ETHANOIC-ACID;ISOMER-A
SpectraBase Compound ID Laek9pcLXCl
InChI InChI=1S/C9H10O2/c10-9(11)5-8-4-6-1-2-7(8)3-6/h1-2,5-7H,3-4H2,(H,10,11)/b8-5+/t6-,7+/m1/s1/i9+1
InChIKey WBTRQFDTGDJTPG-XHFNAJLESA-N
Mol Weight 151.17 g/mol
Molecular Formula C813CH10O2
Exact Mass 151.071434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVfApdeTb3i
Name (bicyclo[2.2.1]hept-5'-en-2'-ylidene) [1-[13C]]ethanoic acid
Alternate Name(s) (bicyclo[2.2.1]hept-5'-en-2'-ylidene) ethanoic acid, 1-[¹³C]-labelled bicyclo[2.2.1]hept-5-en-2-ylideneethanoic acid, 1-[¹³C]-labelled (bicyclo[2.2.1]hept-5'-en-2'-ylidene)[1-[¹³C]]ethanoic acid
Comments Original formula: C8[13C]H10O2
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Formula C9H10O2
InChI InChI=1S/C9H10O2/c10-9(11)5-8-4-6-1-2-7(8)3-6/h1-2,5-7H,3-4H2,(H,10,11)/b8-5+/t6-,7+/m1/s1/i9+1
InChIKey WBTRQFDTGDJTPG-XHFNAJLESA-N
Molecular Weight 151.169 g/mol
SMILES O[13C](\C=C\1[C@]2(C=C[C@@](C1)(C2)[H])[H])=O
SPLASH splash10-1029-7900000000-5b0b28ef740f4b522efb
Source of Spectrum B-43-577-10a
Wiley ID 1147132