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1,1-Dimethyl-2.beta.-hydroxy-9b.alpha.-methoxy-1,2,3,9b-tetrahydro-5H-pyrrolo[2,1-a]isoindol-5-one
SpectraBase Compound ID HPtqntWiRLU
InChI InChI=1S/C14H17NO3/c1-13(2)11(16)8-15-12(17)9-6-4-5-7-10(9)14(13,15)18-3/h4-7,11,16H,8H2,1-3H3/t11-,14+/m0/s1
InChIKey CHPQMDAZSUKGEE-SMDDNHRTSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWtrjBoHu2m
Name 1,1-Dimethyl-2.beta.-hydroxy-9b.alpha.-methoxy-1,2,3,9b-tetrahydro-5H-pyrrolo[2,1-a]isoindol-5-one
Alternate Name(s) (2R,9bR)-2-hydroxy-9b-methoxy-1,1-dimethyl-1,2,3,9b-tetrahydro-5H-pyrrolo[2,1-a]isoindol-5-one
CAS Registry Number 66784-10-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-13(2)11(16)8-15-12(17)9-6-4-5-7-10(9)14(13,15)18-3/h4-7,11,16H,8H2,1-3H3/t11-,14+/m0/s1
InChIKey CHPQMDAZSUKGEE-SMDDNHRTSA-N
Molecular Weight 247.294 g/mol
SMILES O[C@@]1(C([C@]2(N(C(=O)c3c2cccc3)C1)OC)(C)C)[H]
SPLASH splash10-0i00-2590000000-1d4332bfce511148848b
Source of Spectrum J-46-3620-0
Wiley ID 1250023