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1,4-Cyclopentadiene-1-carboxylic acid, 4-amino-3,3-dimethyl-5-phenyl-, methyl ester

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1,4-Cyclopentadiene-1-carboxylic acid, 4-amino-3,3-dimethyl-5-phenyl-, methyl ester
SpectraBase Compound ID 4nvvnzO9Or4
InChI InChI=1S/C15H17NO2/c1-15(2)9-11(14(17)18-3)12(13(15)16)10-7-5-4-6-8-10/h4-9H,16H2,1-3H3
InChIKey WEAFLLCMFKOSFU-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TsEcvZVCaB
Name 1,4-Cyclopentadiene-1-carboxylic acid, 4-amino-3,3-dimethyl-5-phenyl-, methyl ester
Alternate Name(s) 4-Amino-5,5-dimethyl-2-methoxycarbonyl-3-phenyl-cyclopenta-1,3-diene Methyl 4-amino-3,3-dimethyl-5-phenyl-1,4-cyclopentadiene-1-carboxylate
CAS Registry Number 118089-29-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-15(2)9-11(14(17)18-3)12(13(15)16)10-7-5-4-6-8-10/h4-9H,16H2,1-3H3
InChIKey WEAFLLCMFKOSFU-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES NC1=C(C(=CC1(C)C)C(=O)OC)c1ccccc1
SPLASH splash10-0006-0090000000-74f7abe77c1b9fcc1870
Source of Spectrum F-46-1276-13
Wiley ID 1246163