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Ritodrine 3TMS
SpectraBase Compound ID 8VxDioqF5XE
InChI InChI=1S/C26H45NO3Si3/c1-21(27-20-19-22-11-15-24(16-12-22)28-31(2,3)4)26(30-33(8,9)10)23-13-17-25(18-14-23)29-32(5,6)7/h11-18,21,26-27H,19-20H2,1-10H3
InChIKey WIDWQGAXCQQURL-UHFFFAOYSA-N
Mol Weight 503.9 g/mol
Molecular Formula C26H45NO3Si3
Exact Mass 503.270724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5R2wyWXEctd
Name Ritodrine 3TMS
Classification Toccolytic
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Exact Mass 503.270723915 u
Formula C26H45NO3Si3
InChI InChI=1S/C26H45NO3Si3/c1-21(27-20-19-22-11-15-24(16-12-22)28-31(2,3)4)26(30-33(8,9)10)23-13-17-25(18-14-23)29-32(5,6)7/h11-18,21,26-27H,19-20H2,1-10H3
InChIKey WIDWQGAXCQQURL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 503.905 g/mol
Related CAS Registry Number(s) 26652-09-5
SMILES c1c(C(C(C)NCCc2ccc(cc2)O[Si](C)(C)C)O[Si](C)(C)C)ccc(O[Si](C)(C)C)c1
SPLASH splash10-007c-9880000000-a0ad95f24b1275509286
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_6219