CID 3020590

3-methylbuten-2-yl methacrylate

Structural Information

Molecular Formula
C9H14O2
SMILES
CC(C)C(=C)OC(=O)C(=C)C
InChI
InChI=1S/C9H14O2/c1-6(2)8(5)11-9(10)7(3)4/h6H,3,5H2,1-2,4H3
InChIKey
YOKOQKPBIKJVBM-UHFFFAOYSA-N
Compound name
3-methylbut-1-en-2-yl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

154.09938 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.106656 133.8
[M+Na]+ 177.088598 140.0
[M-H]- 153.092104 134.2
[M+NH4]+ 172.133203 154.9
[M+K]+ 193.062538 140.0
[M+H-H2O]+ 137.096640 129.5
[M+HCOO]- 199.097581 153.9
[M+CH3COO]- 213.113231 180.3
[M+Na-2H]- 175.074046 134.6
[M]+ 154.09883142 134.5
[M]- 154.09992858 134.5
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