CID 5365628

2-buten-1-ylsuccinic anhydride

Structural Information

Molecular Formula
C8H10O3
SMILES
C/C=C/CC1CC(=O)OC1=O
InChI
InChI=1S/C8H10O3/c1-2-3-4-6-5-7(9)11-8(6)10/h2-3,6H,4-5H2,1H3/b3-2+
InChIKey
YCYZOWYCOUNUTM-NSCUHMNNSA-N
Compound name
3-[(E)-but-2-enyl]oxolane-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

423
Patents

154.06299 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.07027 129.3
[M+Na]+ 177.05221 137.8
[M-H]- 153.05571 133.7
[M+NH4]+ 172.09681 151.2
[M+K]+ 193.02615 137.4
[M+H-H2O]+ 137.06025 125.0
[M+HCOO]- 199.06119 152.4
[M+CH3COO]- 213.07684 174.1
[M+Na-2H]- 175.03766 133.7
[M]+ 154.06244 130.2
[M]- 154.06354 130.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe