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A-834735
SpectraBase Compound ID A9Dc9rNnObq
InChI InChI=1S/C22H29NO2/c1-21(2)20(22(21,3)4)19(24)17-14-23(13-15-9-11-25-12-10-15)18-8-6-5-7-16(17)18/h5-8,14-15,20H,9-13H2,1-4H3
InChIKey NQTMRZNYLIGQCF-UHFFFAOYSA-N
Mol Weight 339.48 g/mol
Molecular Formula C22H29NO2
Exact Mass 339.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cni9N3d9jPG
Name A-834,735
CAS Registry Number 895155-57-4
Classification Cannabinoid
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 339.219829176 u
Formula C22H29NO2
InChI InChI=1S/C22H29NO2/c1-21(2)20(22(21,3)4)19(24)17-14-23(13-15-9-11-25-12-10-15)18-8-6-5-7-16(17)18/h5-8,14-15,20H,9-13H2,1-4H3
InChIKey NQTMRZNYLIGQCF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 339.479 g/mol
SMILES c1ccc2[n](cc(c2c1)C(=O)C1C(C1(C)C)(C)C)CC1CCOCC1
SPLASH splash10-0abc-6973000000-7b2dbf21d5247e1c1547
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_9671