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(3aS,7aR)-5-(buta-1,3-dien-2-yl)-2-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID JJsvcjtWoZD
InChI InChI=1S/C13H15NO2/c1-4-8(2)9-5-6-10-11(7-9)13(16)14(3)12(10)15/h4-5,10-11H,1-2,6-7H2,3H3/t10-,11+/m1/s1
InChIKey TXGVYUHJYICYDS-MNOVXSKESA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjjeKaisXNH
Name (3aS,7aR)-5-(buta-1,3-dien-2-yl)-2-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-4-8(2)9-5-6-10-11(7-9)13(16)14(3)12(10)15/h4-5,10-11H,1-2,6-7H2,3H3/t10-,11+/m1/s1
InChIKey TXGVYUHJYICYDS-MNOVXSKESA-N
Literature Reference DOI 10.1002/asia.201100455
Molecular Weight 217.268 g/mol
SMILES C1(=CC[C@@]2([C@](C(N(C2=O)C)=O)([H])C1)[H])C(=C)C=C
SPLASH splash10-014i-3890000000-ea376c0f8a762e119762
Source of Spectrum CAJ-6-3248-9
Wiley ID 1773010