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Isoquinoline, decahydro-2-methyl-4a-phenyl-, cis-
SpectraBase Compound ID KksVOUbQ4ZQ
InChI InChI=1S/C16H23N/c1-17-12-11-16(14-7-3-2-4-8-14)10-6-5-9-15(16)13-17/h2-4,7-8,15H,5-6,9-13H2,1H3/t15-,16+/m0/s1
InChIKey ZVUPIZCQKCQXCR-JKSUJKDBSA-N
Mol Weight 229.37 g/mol
Molecular Formula C16H23N
Exact Mass 229.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1JagR1NOsK
Name Isoquinoline, decahydro-2-methyl-4a-phenyl-, cis-
Alternate Name(s) (4aS,8aR)-2-methyl-4a-phenyl-1,3,4,5,6,7,8,8a-octahydroisoquinoline
CAS Registry Number 50790-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23N
InChI InChI=1S/C16H23N/c1-17-12-11-16(14-7-3-2-4-8-14)10-6-5-9-15(16)13-17/h2-4,7-8,15H,5-6,9-13H2,1H3/t15-,16+/m0/s1
InChIKey ZVUPIZCQKCQXCR-JKSUJKDBSA-N
Molecular Weight 229.367 g/mol
SMILES [C@]12([C@](CN(CC2)C)(CCCC1)[H])c1ccccc1
SPLASH splash10-0fbc-6490000000-7c2ef53a68c04445a086
Source of Spectrum C-98-6657-0
Wiley ID 1231004