CID 324854

3205-94-5

Structural Information

Molecular Formula

C₇H₆O₃

SMILES

C1CC2=C(C1)C(=O)OC2=O

InChI

InChI=1S/C7H6O3/c8-6-4-2-1-3-5(4)7(9)10-6/h1-3H2

InChIKey

GBBPFLCLIBNHQO-UHFFFAOYSA-N

Compound name

5,6-dihydro-4H-cyclopenta[c]furan-1,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1580
Patents: 138.0317 Da
Monoisotopic Mass: 0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	139.03898	124.4
[M+Na]+	161.02092	134.7
[M+NH4]+	156.06552	133.2
[M+K]+	176.99486	133.7
[M-H]-	137.02442	126.2
[M+Na-2H]-	159.00637	127.1
[M]+	138.03115	126.1
[M]-	138.03225	126.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe