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3-[12',12'-(dideuterio)- 9',10'-Dihydro-9',10'-ethanoanthracene-11'-ylidene]prop-2-enoic acid
SpectraBase Compound ID ApiPX8JEQFl
InChI InChI=1S/C19H14O2/c20-18(21)10-9-12-11-17-13-5-1-3-7-15(13)19(12)16-8-4-2-6-14(16)17/h1-8,10,17,19H,11H2,(H,20,21)/i11D2
InChIKey ROPUXBBJHOCYOA-ZWGOZCLVSA-N
Mol Weight 276.33 g/mol
Molecular Formula C19H122D2O2
Exact Mass 276.111933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfmjqUhHR4Y
Name 3-[12',12'-(dideuterio)- 9',10'-Dihydro-9',10'-ethanoanthracene-11'-ylidene]prop-2-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C19H12D2O2
InChI InChI=1S/C19H14O2/c20-18(21)10-9-12-11-17-13-5-1-3-7-15(13)19(12)16-8-4-2-6-14(16)17/h1-8,10,17,19H,11H2,(H,20,21)/i11D2
InChIKey ROPUXBBJHOCYOA-ZWGOZCLVSA-N
Molecular Weight 276.331 g/mol
SMILES OC(C=C=C1C2c3ccccc3C(C1([2D])[2D])c1ccccc21)=O
SPLASH splash10-004i-0900000000-099f0fefacfba240be37
Source of Spectrum B-52-667-7
Wiley ID 746510