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Ethyl 5-chloro-1-{(4-methoxyphenyl)amino}-1-methyl-2,3-dihydro-1H-indene-2-carboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 5-chloro-1-{(4-methoxyphenyl)amino}-1-methyl-2,3-dihydro-1H-indene-2-carboxylate
SpectraBase Compound ID LIqtbZ1fjy6
InChI InChI=1S/C20H22ClNO3/c1-4-25-19(23)18-12-13-11-14(21)5-10-17(13)20(18,2)22-15-6-8-16(24-3)9-7-15/h5-11,18,22H,4,12H2,1-3H3/t18-,20-/m0/s1
InChIKey MRRITJMURLDVCY-ICSRJNTNSA-N
Mol Weight 359.85 g/mol
Molecular Formula C20H22ClNO3
Exact Mass 359.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5GakQAytvr
Name Ethyl 5-chloro-1-{(4-methoxyphenyl)amino}-1-methyl-2,3-dihydro-1H-indene-2-carboxylate
Alternate Name(s) (1R,2R)-ethyl 5-chloro-1-((4-methoxyphenyl)amino)-1-methyl-2,3-dihydro-1H-indene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22ClNO3
InChI InChI=1S/C20H22ClNO3/c1-4-25-19(23)18-12-13-11-14(21)5-10-17(13)20(18,2)22-15-6-8-16(24-3)9-7-15/h5-11,18,22H,4,12H2,1-3H3/t18-,20-/m0/s1
InChIKey MRRITJMURLDVCY-ICSRJNTNSA-N
Literature Reference DOI 10.1002/anie.201411808
Molecular Weight 359.853 g/mol
SMILES N(c1ccc(cc1)OC)[C@]1(C)[C@](C(=O)OCC)(Cc2c1ccc(c2)Cl)[H]
SPLASH splash10-076r-0910000000-74ea0f2f767b6783a4cb
Source of Spectrum ACI-54-4092/SMS8-3da
Wiley ID 1760502