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N-[(2R/S)-6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(3R)-3-chloropiperidine
SpectraBase Compound ID 8yKbF4C8Hnk
InChI InChI=1S/C26H34ClNO2/c1-18-19(2)25-23(20(3)24(18)29-16-21-9-6-5-7-10-21)12-13-26(4,30-25)17-28-14-8-11-22(27)15-28/h5-7,9-10,22H,8,11-17H2,1-4H3/t22-,26?/m1/s1
InChIKey WZVNODPJHOYYKU-FPSALIRRSA-N
Mol Weight 428.0 g/mol
Molecular Formula C26H34ClNO2
Exact Mass 427.227807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrXWjklYzuc
Name N-[(2R/S)-6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(3R)-3-chloropiperidine
Comments Less than 3 mono-isotopic peaks
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Formula C26H34ClNO2
InChI InChI=1S/C26H34ClNO2/c1-18-19(2)25-23(20(3)24(18)29-16-21-9-6-5-7-10-21)12-13-26(4,30-25)17-28-14-8-11-22(27)15-28/h5-7,9-10,22H,8,11-17H2,1-4H3/t22-,26?/m1/s1
InChIKey WZVNODPJHOYYKU-FPSALIRRSA-N
Molecular Weight 428.016 g/mol
SMILES c12c(c(C)c(c(c2C)C)OCc2ccccc2)CCC(O1)(CN1C[C@](Cl)(CCC1)[H])C
SPLASH splash10-000i-0009100000-f0e73d96b750d993820a
Source of Spectrum F2-42-3274-14
Synonyms (3R)-3-chloro-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]piperidine (3R)-3-chloro-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)methyl]piperidine (3R)-1-[(6-benzyloxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl]-3-chloro-piperidine (3R)-3-chloranyl-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)methyl]piperidine
Wiley ID 1600269