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Pentazocine TMS
SpectraBase Compound ID IK5OAnATBup
InChI InChI=1S/C22H35NOSi/c1-16(2)10-12-23-13-11-22(4)17(3)21(23)14-18-8-9-19(15-20(18)22)24-25(5,6)7/h8-10,15,17,21H,11-14H2,1-7H3
InChIKey KMKNLGHEFMHPCX-UHFFFAOYSA-N
Mol Weight 357.6 g/mol
Molecular Formula C22H35NOSi
Exact Mass 357.248791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1z9bTjbiAS
Name Pentazocine TMS
Classification Potent analgesic
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Exact Mass 357.248791285 u
Formula C22H35NOSi
InChI InChI=1S/C22H35NOSi/c1-16(2)10-12-23-13-11-22(4)17(3)21(23)14-18-8-9-19(15-20(18)22)24-25(5,6)7/h8-10,15,17,21H,11-14H2,1-7H3
InChIKey KMKNLGHEFMHPCX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.613 g/mol
SMILES C12(c3c(CC(C2C)N(CC1)CC=C(C)C)ccc(c3)O[Si](C)(C)C)C
SPLASH splash10-00di-7692000000-baca345a2635e86f72eb
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_4319