For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Propynyl 5-oxo-5-(4-toluidino)pentanoate
SpectraBase Compound ID Dv7PGLp2f86
InChI InChI=1S/C15H17NO3/c1-3-11-19-15(18)6-4-5-14(17)16-13-9-7-12(2)8-10-13/h1,7-10H,4-6,11H2,2H3,(H,16,17)
InChIKey NYHGMQQLDNACAE-UHFFFAOYSA-N
Mol Weight 259.3 g/mol
Molecular Formula C15H17NO3
Exact Mass 259.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LfQpcx9ByKR
Name 2-Propynyl 5-oxo-5-(4-toluidino)pentanoate
CAS Registry Number 300726-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO3
InChI InChI=1S/C15H17NO3/c1-3-11-19-15(18)6-4-5-14(17)16-13-9-7-12(2)8-10-13/h1,7-10H,4-6,11H2,2H3,(H,16,17)
InChIKey NYHGMQQLDNACAE-UHFFFAOYSA-N
Molecular Weight 259.305 g/mol
SMILES N(C(CCCC(OCC#C)=O)=O)c1ccc(cc1)C
SPLASH splash10-0a4i-7910000000-5e4bcfc6f2d5c738770d
Source of Spectrum AD-0-2532-0
Synonyms 5-(4-Methylanilino)-5-oxopentanoic acid prop-2-ynyl ester 5-keto-5-(p-toluidino)valeric acid propargyl ester Pentanoic acid, 5-(4-methylphenylamino)-5-oxo-, 2-propynyl ester Prop-2-ynyl 5-(4-methylanilino)-5-oxo-pentanoate Prop-2-ynyl 5-[(4-methylphenyl)amino]-5-oxidanylidene-pentanoate
Wiley ID 1430355