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Sildenafil
SpectraBase Compound ID 9yv3RAUt40G
InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)
InChIKey BNRNXUUZRGQAQC-UHFFFAOYSA-N
Mol Weight 474.58 g/mol
Molecular Formula C22H30N6O4S
Exact Mass 474.204925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbetYUDp9jR
Name Sildenafil
CAS Registry Number 139755-83-2
Classification Vasodilator
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 474.204924640 u
Formula C22H30N6O4S
InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)
InChIKey BNRNXUUZRGQAQC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 474.580 g/mol
SMILES c12c([n](C)nc2CCC)C(=O)NC(=N1)c1cc(S(N2CCN(CC2)C)(=O)=O)ccc1OCC
SPLASH splash10-0002-9100100000-bd30840726191b354971
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_5713