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Methylhexanamine
SpectraBase Compound ID 3ge6iWUaAwM
InChI InChI=1S/C7H17N/c1-4-6(2)5-7(3)8/h6-7H,4-5,8H2,1-3H3
InChIKey YAHRDLICUYEDAU-UHFFFAOYSA-N
Mol Weight 115.22 g/mol
Molecular Formula C7H17N
Exact Mass 115.1361 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID uVevtaeffC
Name Geranamine ##
CAS Registry Number 105-41-9
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-135.00]
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Formula C7H17N
InChI InChI=1S/C7H17N/c1-4-6(2)5-7(3)8/h6-7H,4-5,8H2,1-3H3
InChIKey YAHRDLICUYEDAU-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES NC(CC(C)CC)C
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD