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4-Pentenoic acid, 2-(2-amino-2-oxoethyl)-2-methyl-, ethyl ester, (.+-.)-

View entire compound with spectra: 1 MS (GC)

4-Pentenoic acid, 2-(2-amino-2-oxoethyl)-2-methyl-, ethyl ester, (.+-.)-
SpectraBase Compound ID KvK6ofaM0eQ
InChI InChI=1S/C10H17NO3/c1-4-6-10(3,7-8(11)12)9(13)14-5-2/h4H,1,5-7H2,2-3H3,(H2,11,12)
InChIKey AODWHFNLEYHSPR-UHFFFAOYSA-N
Mol Weight 199.25 g/mol
Molecular Formula C10H17NO3
Exact Mass 199.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5KyRnGZ00w
Name 4-Pentenoic acid, 2-(2-amino-2-oxoethyl)-2-methyl-, ethyl ester, (.+-.)-
Alternate Name(s) (RS)-3-ethoxycarbonyl-3-methylhex-5-enamide Ethyl 2-(2-amino-2-oxoethyl)-2-methyl-4-pentenoate
CAS Registry Number 113661-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO3
InChI InChI=1S/C10H17NO3/c1-4-6-10(3,7-8(11)12)9(13)14-5-2/h4H,1,5-7H2,2-3H3,(H2,11,12)
InChIKey AODWHFNLEYHSPR-UHFFFAOYSA-N
Molecular Weight 199.250 g/mol
SMILES NC(CC(C(=O)OCC)(CC=C)C)=O
SPLASH splash10-0a4i-9300000000-9ed0204cd5cde0b4e5de
Source of Spectrum KC-1987-1683-21
Wiley ID 1196662