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

*Links on SpectraBase are not permalinks.
(3aS,6aS)-4-(3,6-Dioxooctahydropentalen-1-yl)butanal
SpectraBase Compound ID 7FzpiEbwrbt
InChI InChI=1S/C12H16O3/c13-6-2-1-3-8-7-11(15)9-4-5-10(14)12(8)9/h6,8-9,12H,1-5,7H2/t8?,9-,12+/m1/s1
InChIKey HXHLVCUPMLHWEX-IBMSWFNTSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 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 EpPJbQdzY7d
Name (3aS,6aS)-4-(3,6-Dioxooctahydropentalen-1-yl)butanal
Alternate Name(s) 4-(3,6-Dioxooctahydropentalen-1-yl)butanal 4-((3aS,6aS)-3,6-dioxooctahydropentalen-1-yl)butanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c13-6-2-1-3-8-7-11(15)9-4-5-10(14)12(8)9/h6,8-9,12H,1-5,7H2/t8?,9-,12+/m1/s1
InChIKey HXHLVCUPMLHWEX-IBMSWFNTSA-N
Molecular Weight 208.257 g/mol
SMILES C1([C@@]2([C@](C(=O)CC2)([H])C(C1)CCCC=O)[H])=O
SPLASH splash10-0bu9-7900000000-ec559696727597237824
Source of Spectrum F-69-7377-18
Wiley ID 1738309