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1-(1-Azepanyl)-4,4-dimethyl-3-pentanone
SpectraBase Compound ID Ex7dIGIFivD
InChI InChI=1S/C13H25NO/c1-13(2,3)12(15)8-11-14-9-6-4-5-7-10-14/h4-11H2,1-3H3
InChIKey PWCOVTDCSAVPDH-UHFFFAOYSA-N
Mol Weight 211.35 g/mol
Molecular Formula C13H25NO
Exact Mass 211.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTxG7agcmAL
Name 1-(1-Azepanyl)-4,4-dimethyl-3-pentanone
CAS Registry Number 93258-02-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H25NO
InChI InChI=1S/C13H25NO/c1-13(2,3)12(15)8-11-14-9-6-4-5-7-10-14/h4-11H2,1-3H3
InChIKey PWCOVTDCSAVPDH-UHFFFAOYSA-N
Molecular Weight 211.349 g/mol
SMILES C1CCCN(CC1)CCC(C(C)(C)C)=O
SPLASH splash10-03di-7910000000-16ca2bc67f52d3f3c03e
Source of Spectrum AD-0-2532-0
Synonyms 1-(azepan-1-yl)-4,4-dimethyl-pentan-3-one Pentan-3-one, 1-(1-perhydroazepinyl)-4,4-dimethyl-
Wiley ID 1431270