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5-Chloro-AB-PINACA 3TMS
SpectraBase Compound ID 9EW1IDhqFxf
InChI InChI=1S/C27H49ClN4O2Si3/c1-21(2)25(27(34)32(36(6,7)8)37(9,10)11)31(35(3,4)5)26(33)24-22-17-13-14-18-23(22)30(29-24)20-16-12-15-19-28/h13-14,17-18,21,25H,12,15-16,19-20H2,1-11H3
InChIKey DFGLQGPLFMCJFA-UHFFFAOYSA-N
Mol Weight 581.4 g/mol
Molecular Formula C27H49ClN4O2Si3
Exact Mass 580.285184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GjYfHUvtu5k
Name 5-Chloro-AB-PINACA 3TMS
Classification Cannabinoid
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 580.285184137 u
Formula C27H49N4O2ClSi3
InChI InChI=1S/C27H49ClN4O2Si3/c1-21(2)25(27(34)32(36(6,7)8)37(9,10)11)31(35(3,4)5)26(33)24-22-17-13-14-18-23(22)30(29-24)20-16-12-15-19-28/h13-14,17-18,21,25H,12,15-16,19-20H2,1-11H3
InChIKey DFGLQGPLFMCJFA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 581.423 g/mol
SMILES c1cc2c([n](nc2C(=O)N([Si](C)(C)C)C(C(N([Si](C)(C)C)[Si](C)(C)C)=O)C(C)C)CCCCCCl)cc1
SPLASH splash10-00ds-7944010000-2aefb18d9690e73cd27f
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_9687