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Spiro[cyclohexane-1,3'(2'H)-isoquinoline]-4',7'-diol, 1',4'-dihydro-6'-methoxy-4'-(phenylmethyl)-
SpectraBase Compound ID ARhITEUq2iP
InChI InChI=1S/C22H27NO3/c1-26-20-13-18-17(12-19(20)24)15-23-21(10-6-3-7-11-21)22(18,25)14-16-8-4-2-5-9-16/h2,4-5,8-9,12-13,23-25H,3,6-7,10-11,14-15H2,1H3
InChIKey LFDLFXOYLIFMNY-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C22H27NO3
Exact Mass 353.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tL2p0tikNY
Name Spiro[cyclohexane-1,3'(2'H)-isoquinoline]-4',7'-diol, 1',4'-dihydro-6'-methoxy-4'-(phenylmethyl)-
CAS Registry Number 108439-62-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO3
InChI InChI=1S/C22H27NO3/c1-26-20-13-18-17(12-19(20)24)15-23-21(10-6-3-7-11-21)22(18,25)14-16-8-4-2-5-9-16/h2,4-5,8-9,12-13,23-25H,3,6-7,10-11,14-15H2,1H3
InChIKey LFDLFXOYLIFMNY-UHFFFAOYSA-N
Molecular Weight 353.462 g/mol
SMILES Oc1cc2c(C(C3(NC2)CCCCC3)(Cc2ccccc2)O)cc1OC
SPLASH splash10-00kb-9633000000-2cfcb7754245836be265
Source of Spectrum KC-1986-1337-0
Synonyms 4'-benzyl-6'-methoxy-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinoline]-4',7'-diol Spiro[cyclohexane-1,3'(2'H)-6'-methoxy-4'-benzyl-4',7'-dihydroxy-1,2,3,4-tetrahydroisoquinoline]
Wiley ID 1344084