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(4aS,7aS)-4-(1,3-benzodioxol-5-yl)-1-methyl-2,4a,7,7a-tetrahydro-1-pyrindine
SpectraBase Compound ID 9JhbQmpFtFj
InChI InChI=1S/C16H17NO2/c1-17-8-7-12(13-3-2-4-14(13)17)11-5-6-15-16(9-11)19-10-18-15/h2-3,5-7,9,13-14H,4,8,10H2,1H3/t13-,14-/m0/s1
InChIKey SMTAEYBXJRGFAX-KBPBESRZSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B34H80apV5c
Name (4aS,7aS)-4-(1,3-benzodioxol-5-yl)-1-methyl-2,4a,7,7a-tetrahydro-1-pyrindine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-17-8-7-12(13-3-2-4-14(13)17)11-5-6-15-16(9-11)19-10-18-15/h2-3,5-7,9,13-14H,4,8,10H2,1H3/t13-,14-/m0/s1
InChIKey SMTAEYBXJRGFAX-KBPBESRZSA-N
Molecular Weight 255.317 g/mol
SMILES C=1([C@]2([C@@](CC=C2)([H])N(CC1)C)[H])c1cc2OCOc2cc1
SPLASH splash10-0pvl-2590000000-4c3c8a74f9013c6aad38
Source of Spectrum J-59-5671-41
Synonyms (4aS,7aS)-4-(1,3-benzodioxol-5-yl)-1-methyl-2,4a,7,7a-tetrahydrocyclopenta[b]pyridine
Wiley ID 1258967