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2-[6-chloro-1-(chloromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid ethyl ester
SpectraBase Compound ID 1kPRAsa7V8y
InChI InChI=1S/C16H17Cl2NO3/c1-2-21-14(20)8-16(9-17)15-11(5-6-22-16)12-7-10(18)3-4-13(12)19-15/h3-4,7,19H,2,5-6,8-9H2,1H3
InChIKey RJYOPSYFXRHNEB-UHFFFAOYSA-N
Mol Weight 342.22 g/mol
Molecular Formula C16H17Cl2NO3
Exact Mass 341.058549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33YaB34DoYD
Name 2-[6-chloro-1-(chloromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid ethyl ester
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Formula C16H17Cl2NO3
InChI InChI=1S/C16H17Cl2NO3/c1-2-21-14(20)8-16(9-17)15-11(5-6-22-16)12-7-10(18)3-4-13(12)19-15/h3-4,7,19H,2,5-6,8-9H2,1H3
InChIKey RJYOPSYFXRHNEB-UHFFFAOYSA-N
Molecular Weight 342.222 g/mol
SMILES [nH]1c2ccc(cc2c2c1C(OCC2)(CC(=O)OCC)CCl)Cl
SPLASH splash10-0006-0093000000-ac33de7939aed541bcb3
Source of Spectrum O1-60-1101-29
Synonyms 2-[6-chloro-1-(chloromethyl)-4,9-dihydro-3H-pyran[3,4-b]indol-1-yl]acetic acid ethyl ester Ethyl 2-[6-chloranyl-1-(chloromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoate Ethyl 2-[6-chloro-1-(chloromethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetate
Wiley ID 1592055