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ZTKQXICPROHRHJ-UHFFFAOYSA-N
SpectraBase Compound ID KApHbBEDuTh
InChI InChI=1S/C14H19NO5S/c1-9-14(16)11-8-13(20-3)12(19-2)7-10(11)5-6-15(9)21(4,17)18/h7-9H,5-6H2,1-4H3
InChIKey ZTKQXICPROHRHJ-UHFFFAOYSA-N
Mol Weight 313.37 g/mol
Molecular Formula C14H19NO5S
Exact Mass 313.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Xmz7bPpBgy
Name 7,8-Dimethoxy-2-methyl-3-methanesulfonyl-2,3,4,5-tetrahydro-benzo[d]azepin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H19NO5S
InChI InChI=1S/C14H19NO5S/c1-9-14(16)11-8-13(20-3)12(19-2)7-10(11)5-6-15(9)21(4,17)18/h7-9H,5-6H2,1-4H3
InChIKey ZTKQXICPROHRHJ-UHFFFAOYSA-N
Molecular Weight 313.368 g/mol
SMILES C1(N(S(=O)(=O)C)CCc2cc(c(cc2C1=O)OC)OC)C
SPLASH splash10-001i-0093000000-737dfbe38bd1772131a6
Source of Spectrum H1-45-1125-2
Synonyms 2-Methyl-7,8-dimethoxy-3-methanesulfonylbenzaepinone 7,8-dimethoxy-2-methyl-3-(methylsulfonyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-1-one
Wiley ID 758301