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N,2,2-trimethyl-6-heptynoic acid, amide
SpectraBase Compound ID DlTcQyD5fOP
InChI InChI=1S/C10H17NO/c1-5-6-7-8-10(2,3)9(12)11-4/h1H,6-8H2,2-4H3,(H,11,12)
InChIKey KKRLHPSQAMEGDL-UHFFFAOYSA-N
Mol Weight 167.25 g/mol
Molecular Formula C10H17NO
Exact Mass 167.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuVcIZhoFmq
Name N,2,2-trimethyl-6-heptynoic acid, amide
Alternate Name(s) N,2,2-trimethyl-6-heptyamide N,2,2-trimethyl-6-heptynamide
CAS Registry Number 120085-77-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO
InChI InChI=1S/C10H17NO/c1-5-6-7-8-10(2,3)9(12)11-4/h1H,6-8H2,2-4H3,(H,11,12)
InChIKey KKRLHPSQAMEGDL-UHFFFAOYSA-N
Molecular Weight 167.252 g/mol
SMILES N(C(C(CCCC#C)(C)C)=O)C
SPLASH splash10-0udi-9800000000-8157c79d7cf4a9ae95d7
Source of Spectrum K-122-1085-14
Wiley ID 1163744