CID 131674688

Cellulose, carboxymethyl ether, sodium salt

Structural Information

Molecular Formula
C16H28O7
SMILES
CC1CCC(OC1COCC2CCCC(O2)CCC(=O)OO)O
InChI
InChI=1S/C16H28O7/c1-11-5-7-15(17)22-14(11)10-20-9-13-4-2-3-12(21-13)6-8-16(18)23-19/h11-15,17,19H,2-10H2,1H3
InChIKey
VHOCHYNFQXBVGU-UHFFFAOYSA-N
Compound name
3-[6-[(6-hydroxy-3-methyloxan-2-yl)methoxymethyl]oxan-2-yl]propaneperoxoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

332.1835 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.19078 178.2
[M+Na]+ 355.17272 185.1
[M+NH4]+ 350.21732 182.7
[M+K]+ 371.14666 182.5
[M-H]- 331.17622 180.8
[M+Na-2H]- 353.15817 177.6
[M]+ 332.18295 179.4
[M]- 332.18405 179.4
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

No patent data available for this compound.