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

*Links on SpectraBase are not permalinks.
2-[(2-isopropoxy-3,4-diketo-cyclobuten-1-yl)methyl]isoindoline-1,3-quinone
SpectraBase Compound ID JdxTsotlEnr
InChI InChI=1S/C16H13NO5/c1-8(2)22-14-11(12(18)13(14)19)7-17-15(20)9-5-3-4-6-10(9)16(17)21/h3-6,8H,7H2,1-2H3
InChIKey QWHYSFVAGOKMNV-UHFFFAOYSA-N
Mol Weight 299.28 g/mol
Molecular Formula C16H13NO5
Exact Mass 299.079373 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 KjwgvFIewZM
Name 2-[(2-isopropoxy-3,4-diketo-cyclobuten-1-yl)methyl]isoindoline-1,3-quinone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO5
InChI InChI=1S/C16H13NO5/c1-8(2)22-14-11(12(18)13(14)19)7-17-15(20)9-5-3-4-6-10(9)16(17)21/h3-6,8H,7H2,1-2H3
InChIKey QWHYSFVAGOKMNV-UHFFFAOYSA-N
Molecular Weight 299.282 g/mol
SMILES C1(N(C(c2ccccc12)=O)CC1=C(OC(C)C)C(C1=O)=O)=O
SPLASH splash10-03di-0940000000-2baa053b65c85433cb12
Source of Spectrum J-60-1472-5
Synonyms 2-[(2-isopropoxy-3,4-dioxo-cyclobuten-1-yl)methyl]isoindoline-1,3-dione 2-[(3,4-dioxo-2-propan-2-yloxy-1-cyclobutenyl)methyl]isoindole-1,3-dione 2-[(3,4-dioxo-2-propan-2-yloxycyclobuten-1-yl)methyl]isoindole-1,3-dione 2-[[3,4-bis(oxidanylidene)-2-propan-2-yloxy-cyclobuten-1-yl]methyl]isoindole-1,3-dione
Wiley ID 1301930