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2-[1-(chloromethyl)-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid ethyl ester
SpectraBase Compound ID 487gYBMxweb
InChI InChI=1S/C18H22ClNO3/c1-3-12-6-5-7-13-14-8-9-23-18(11-19,10-15(21)22-4-2)17(14)20-16(12)13/h5-7,20H,3-4,8-11H2,1-2H3
InChIKey SOVCWZWPLMDOIL-UHFFFAOYSA-N
Mol Weight 335.83 g/mol
Molecular Formula C18H22ClNO3
Exact Mass 335.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPdSr4h3dwA
Name 2-[1-(chloromethyl)-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid ethyl ester
Alternate Name(s) 2-[1-(chloromethyl)-8-ethyl-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid ethyl ester Ethyl 2-[1-(chloromethyl)-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetate Ethyl 2-[1-(chloromethyl)-8-ethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoate
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Formula C18H22ClNO3
InChI InChI=1S/C18H22ClNO3/c1-3-12-6-5-7-13-14-8-9-23-18(11-19,10-15(21)22-4-2)17(14)20-16(12)13/h5-7,20H,3-4,8-11H2,1-2H3
InChIKey SOVCWZWPLMDOIL-UHFFFAOYSA-N
Molecular Weight 335.831 g/mol
SMILES [nH]1c2c(cccc2c2c1C(OCC2)(CC(=O)OCC)CCl)CC
SPLASH splash10-000i-0193000000-f9dbda6d5aa653817724
Source of Spectrum O1-60-1102-5
Wiley ID 1592054