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Cyproheptadine
SpectraBase Compound ID 9JHfmDSfzmX
InChI InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3
InChIKey JJCFRYNCJDLXIK-UHFFFAOYSA-N
Mol Weight 287.41 g/mol
Molecular Formula C21H21N
Exact Mass 287.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HZhqPx1G3j
Name Cyproheptadine
CAS Registry Number 129-03-3
Classification Serotonin antagonist
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.167399680 u
Formula C21H21N
InChI InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3
InChIKey JJCFRYNCJDLXIK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.406 g/mol
SMILES C1(CCN(CC1)C)=C1c2c(C=Cc3c1cccc3)cccc2
SPLASH splash10-000i-3190000000-8e6943a74243cf475c26
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.
Sample Preparation Procedure Detected: G U+UHYAC
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_710