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Hexamethylenetetramine
SpectraBase Compound ID 9L5t07EWMFZ
InChI InChI=1S/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H2
InChIKey VKYKSIONXSXAKP-UHFFFAOYSA-N
Mol Weight 140.19 g/mol
Molecular Formula C6H12N4
Exact Mass 140.106196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2I4kV3aqFvl
Name Methenamine
CAS Registry Number 100-97-0
Classification Urinary antiseptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 140.106196402 u
Formula C6H12N4
InChI InChI=1S/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H2
InChIKey VKYKSIONXSXAKP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 140.190 g/mol
SMILES C1N2CN3CN(CN1C3)C2
SPLASH splash10-0006-9700000000-7bd9fbc50a2de11a6b14
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1107