CID 7274

Allyl methacrylate

Structural Information

Molecular Formula
C7H10O2
SMILES
CC(=C)C(=O)OCC=C
InChI
InChI=1S/C7H10O2/c1-4-5-9-7(8)6(2)3/h4H,1-2,5H2,3H3
InChIKey
FBCQUCJYYPMKRO-UHFFFAOYSA-N
Compound name
prop-2-enyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

11
References

116437
Patents

126.06808 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.07536 125.0
[M+Na]+ 149.05730 132.4
[M-H]- 125.06080 125.5
[M+NH4]+ 144.10190 147.2
[M+K]+ 165.03124 132.0
[M+H-H2O]+ 109.06534 120.8
[M+HCOO]- 171.06628 147.7
[M+CH3COO]- 185.08193 172.4
[M+Na-2H]- 147.04275 129.3
[M]+ 126.06753 126.1
[M]- 126.06863 126.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe