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1-[(2-chloro-1-oxoethyl)amino]-7-hydroxy-2,2,6-trimethyl-1,3-dihydroindene-4-carboxylic acid methyl ester
SpectraBase Compound ID AygvloJApMB
InChI InChI=1S/C16H20ClNO4/c1-8-5-9(15(21)22-4)10-6-16(2,3)14(12(10)13(8)20)18-11(19)7-17/h5,14,20H,6-7H2,1-4H3,(H,18,19)
InChIKey PBEXXSSHKTZKTR-UHFFFAOYSA-N
Mol Weight 325.79 g/mol
Molecular Formula C16H20ClNO4
Exact Mass 325.108086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBVhsaD9z7k
Name 1-[(2-chloro-1-oxoethyl)amino]-7-hydroxy-2,2,6-trimethyl-1,3-dihydroindene-4-carboxylic acid methyl ester
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Formula C16H20ClNO4
InChI InChI=1S/C16H20ClNO4/c1-8-5-9(15(21)22-4)10-6-16(2,3)14(12(10)13(8)20)18-11(19)7-17/h5,14,20H,6-7H2,1-4H3,(H,18,19)
InChIKey PBEXXSSHKTZKTR-UHFFFAOYSA-N
Molecular Weight 325.792 g/mol
SMILES Oc1c(cc(c2CC(C(c12)NC(=O)CCl)(C)C)C(=O)OC)C
SPLASH splash10-0089-0291000000-9e098a9ca6b5b012cba3
Source of Spectrum E1-45-732-23
Synonyms 1-[(2-chloroacetyl)amino]-7-hydroxy-2,2,6-trimethyl-indane-4-carboxylic acid methyl ester Methyl 1-(2-chloranylethanoylamino)-2,2,6-trimethyl-7-oxidanyl-1,3-dihydroindene-4-carboxylate Methyl 1-[(2-chloroacetyl)amino]-7-hydroxy-2,2,6-trimethyl-1,3-dihydroindene-4-carboxylate Methyl 1-[(2-chloroacetyl)amino]-7-hydroxy-2,2,6-trimethyl-indane-4-carboxylate
Wiley ID 1553850