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5-Phenyl-4-pentanone-p-nitrobenzoate
SpectraBase Compound ID 9EAPecEUmhm
InChI InChI=1S/C18H17NO5/c20-17(13-14-5-2-1-3-6-14)7-4-12-24-18(21)15-8-10-16(11-9-15)19(22)23/h1-3,5-6,8-11H,4,7,12-13H2
InChIKey NYYVHZPOTPAGSX-UHFFFAOYSA-N
Mol Weight 327.34 g/mol
Molecular Formula C18H17NO5
Exact Mass 327.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWCZM3YxazI
Name 5-Phenyl-4-pentanone-p-nitrobenzoate
Alternate Name(s) 4-Oxo-5-phenylpentyl 4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO5
InChI InChI=1S/C18H17NO5/c20-17(13-14-5-2-1-3-6-14)7-4-12-24-18(21)15-8-10-16(11-9-15)19(22)23/h1-3,5-6,8-11H,4,7,12-13H2
InChIKey NYYVHZPOTPAGSX-UHFFFAOYSA-N
Molecular Weight 327.336 g/mol
SMILES c1(N(=O)=O)ccc(C(=O)OCCCC(=O)Cc2ccccc2)cc1
SPLASH splash10-0udi-3900000000-e117d682a74a04c01af3
Source of Spectrum GT-1986-42-0
Wiley ID 1325512