CID 17538

Glycine, n,n-diisobutyl-, ethyl ester

Structural Information

Molecular Formula
C12H25NO2
SMILES
CCOC(=O)CN(CC(C)C)CC(C)C
InChI
InChI=1S/C12H25NO2/c1-6-15-12(14)9-13(7-10(2)3)8-11(4)5/h10-11H,6-9H2,1-5H3
InChIKey
RUANENNXSBNRIP-UHFFFAOYSA-N
Compound name
ethyl 2-[bis(2-methylpropyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.18852 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.19580 156.4
[M+Na]+ 238.17774 160.2
[M-H]- 214.18124 157.4
[M+NH4]+ 233.22234 175.5
[M+K]+ 254.15168 161.5
[M+H-H2O]+ 198.18578 150.4
[M+HCOO]- 260.18672 177.5
[M+CH3COO]- 274.20237 198.6
[M+Na-2H]- 236.16319 156.0
[M]+ 215.18797 160.6
[M]- 215.18907 160.6
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