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3-BENZOYLOXY-2,5,5-TRIMETHYL-4-PHENYL-1-PYRROLINE
SpectraBase Compound ID AJadfyv5QMK
InChI InChI=1S/C20H21NO2/c1-14-18(23-19(22)16-12-8-5-9-13-16)17(20(2,3)21-14)15-10-6-4-7-11-15/h4-13,17-18H,1-3H3
InChIKey NJVOYWIZXQDXOQ-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7D6n9KwWysI
Name (2,5,5-trimethyl-4-phenyl-3,4-dihydropyrrol-3-yl) benzoate
CAS Registry Number 122546-89-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-14-18(23-19(22)16-12-8-5-9-13-16)17(20(2,3)21-14)15-10-6-4-7-11-15/h4-13,17-18H,1-3H3
InChIKey NJVOYWIZXQDXOQ-UHFFFAOYSA-N
Molecular Weight 307.393 g/mol
SMILES C1(N=C(C(C1c1ccccc1)OC(=O)c1ccccc1)C)(C)C
SPLASH splash10-000i-0900000000-4f0e5ea69d8219849b80
Source of Spectrum B-42-75-3
Synonyms benzoic acid (2,5,5-trimethyl-4-phenyl-1-pyrrolin-3-yl) ester benzoic acid (2,5,5-trimethyl-4-phenyl-3,4-dihydropyrrol-3-yl) ester
Wiley ID 1309170