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3-[2,2-Dimethyl-7-nitro-2H-benzopyran-6-yl]acrylic acid
SpectraBase Compound ID FawvqKfTgXy
InChI InChI=1S/C14H13NO5/c1-14(2)6-5-10-7-9(3-4-13(16)17)11(15(18)19)8-12(10)20-14/h3-8H,1-2H3,(H,16,17)/b4-3+
InChIKey SRGFGDVGSXOHPH-ONEGZZNKSA-N
Mol Weight 275.26 g/mol
Molecular Formula C14H13NO5
Exact Mass 275.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhXKy3BHdia
Name 3-[2,2-Dimethyl-7-nitro-2H-benzopyran-6-yl]acrylic acid
Alternate Name(s) (2E)-3-(2,2-dimethyl-7-nitro-2H-chromen-6-yl)-2-propenoic acid
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Formula C14H13NO5
InChI InChI=1S/C14H13NO5/c1-14(2)6-5-10-7-9(3-4-13(16)17)11(15(18)19)8-12(10)20-14/h3-8H,1-2H3,(H,16,17)/b4-3+
InChIKey SRGFGDVGSXOHPH-ONEGZZNKSA-N
Molecular Weight 275.260 g/mol
SMILES OC(\C=C\c1c(N(=O)=O)cc2OC(C)(C)C=Cc2c1)=O
SPLASH splash10-03di-0390000000-fe68577c4ec3ff213d05
Source of Spectrum SO-0-1250-14
Wiley ID 874912