For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(3aR,4S,7aS)-rel-4-(2-hydroxyethyl)-2-methyl-5-vinyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID JSxPPO71tB8
InChI InChI=1S/C13H17NO3/c1-3-8-4-5-10-11(9(8)6-7-15)13(17)14(2)12(10)16/h3-4,9-11,15H,1,5-7H2,2H3/t9-,10+,11-/m1/s1
InChIKey OYAGMCKECSLHSK-OUAUKWLOSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GOGTHealcFw
Name (3aR,4S,7aS)-rel-4-(2-hydroxyethyl)-2-methyl-5-vinyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Alternate Name(s) (3aR,4S,7aS)-4-(2-hydroxyethyl)-2-methyl-5-vinyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-3-8-4-5-10-11(9(8)6-7-15)13(17)14(2)12(10)16/h3-4,9-11,15H,1,5-7H2,2H3/t9-,10+,11-/m1/s1
InChIKey OYAGMCKECSLHSK-OUAUKWLOSA-N
Literature Reference DOI 10.1021/ol062869d
Molecular Weight 235.283 g/mol
SMILES OCC[C@@]1(C(C=C)=CC[C@@]2(C(N(C(=O)[C@]12[H])C)=O)[H])[H]
SPLASH splash10-052f-1910000000-e84f8b962d3b27488564
Source of Spectrum A1-9-615/SMS11-10
Wiley ID 1757844