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Azacyclotridecan-2-one, 1-[3-[(phenylmethyl)amino]propyl]-
SpectraBase Compound ID KbpjTfhsve5
InChI InChI=1S/C22H36N2O/c25-22-16-11-6-4-2-1-3-5-7-12-18-24(22)19-13-17-23-20-21-14-9-8-10-15-21/h8-10,14-15,23H,1-7,11-13,16-20H2
InChIKey MHZYSPSVYYGYJD-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H36N2O
Exact Mass 344.282764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcoNvM19zUQ
Name Azacyclotridecan-2-one, 1-[3-[(phenylmethyl)amino]propyl]-
Alternate Name(s) 1-[3-(benzylamino)propyl]azacyclotridecan-2-one 13-(3'-Benzylaminopropyl)-12-dodecanlactam
CAS Registry Number 72636-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O
InChI InChI=1S/C22H36N2O/c25-22-16-11-6-4-2-1-3-5-7-12-18-24(22)19-13-17-23-20-21-14-9-8-10-15-21/h8-10,14-15,23H,1-7,11-13,16-20H2
InChIKey MHZYSPSVYYGYJD-UHFFFAOYSA-N
Molecular Weight 344.543 g/mol
SMILES N(CCCN1C(=O)CCCCCCCCCCC1)Cc1ccccc1
SPLASH splash10-052g-9740000000-ca49977471b146b6b055
Source of Spectrum H-62-1940-0
Wiley ID 1338286