CID 12761634

Lactyltrimethylammonium betaine

Structural Information

Molecular Formula
C6H14AsO3
SMILES
C[As+](C)(C)CC(C(=O)O)O
InChI
InChI=1S/C6H13AsO3/c1-7(2,3)4-5(8)6(9)10/h5,8H,4H2,1-3H3/p+1
InChIKey
UTNVEWHQVLDCMX-UHFFFAOYSA-O
Compound name
(2-carboxy-2-hydroxyethyl)-trimethylarsanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.01588 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.02316 142.9
[M+Na]+ 232.00510 148.8
[M-H]- 208.00860 140.5
[M+NH4]+ 227.04970 162.1
[M+K]+ 247.97904 142.9
[M+H-H2O]+ 192.01314 141.6
[M+HCOO]- 254.01408 160.0
[M+CH3COO]- 268.02973 166.8
[M+Na-2H]- 229.99055 148.0
[M]+ 209.01533 141.3
[M]- 209.01643 141.3
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.