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.epsilon.-Ccaprolactam, 1TMS
SpectraBase Compound ID tmyxwNFpuO
InChI InChI=1S/C9H19NOSi/c1-12(2,3)10-8-6-4-5-7-9(10)11/h4-8H2,1-3H3
InChIKey RPVBFFYNFVTCBX-UHFFFAOYSA-N
Mol Weight 185.34 g/mol
Molecular Formula C9H19NOSi
Exact Mass 185.123591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgFVY3DphtE
Name .epsilon.-Ccaprolactam, 1TMS
Comments Derivatization type: 1 TMS (mass: 185.124); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000673; Note: The molecular formula of the structure shown is C6H11NO - which differs from the formula reported for the mass spectrum (C9H19NOSi)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H19NOSi
InChI InChI=1S/C9H19NOSi/c1-12(2,3)10-8-6-4-5-7-9(10)11/h4-8H2,1-3H3
InChIKey RPVBFFYNFVTCBX-UHFFFAOYSA-N
Molecular Weight 185.342 g/mol
SMILES C1CCC(N(CC1)[Si](C)(C)C)=O
SPLASH splash10-00di-3900000000-bb10428360d9a14b012b
Source of Spectrum FM-2019-673-0
Synonyms epsilon-Caprolactam, 1TMS 6-Caprolactam, 1TMS Caprolactam, 1TMS Hexanone isoxime, 1TMS Hexanolactam, 1TMS 6-Hexanelactam, 1TMS Azepan-2-one, 1TMS 1-(Trimethylsilyl)azepan-2-one
Wiley ID 1818351