CID 3612688

1,14-tetradecanediol dimethacrylate

Structural Information

Molecular Formula
C22H38O4
SMILES
CC(=C)C(=O)OCCCCCCCCCCCCCCOC(=O)C(=C)C
InChI
InChI=1S/C22H38O4/c1-19(2)21(23)25-17-15-13-11-9-7-5-6-8-10-12-14-16-18-26-22(24)20(3)4/h1,3,5-18H2,2,4H3
InChIKey
PYLRGSOFJMYQNO-UHFFFAOYSA-N
Compound name
14-(2-methylprop-2-enoyloxy)tetradecyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

630
Patents

366.277 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.28428 198.7
[M+Na]+ 389.26622 199.7
[M-H]- 365.26972 196.5
[M+NH4]+ 384.31082 205.0
[M+K]+ 405.24016 196.8
[M+H-H2O]+ 349.27426 191.6
[M+HCOO]- 411.27520 207.0
[M+CH3COO]- 425.29085 221.2
[M+Na-2H]- 387.25167 192.6
[M]+ 366.27645 206.4
[M]- 366.27755 206.4
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