CID 7348

N-lauroylsarcosine

Structural Information

Molecular Formula
C15H29NO3
SMILES
CCCCCCCCCCCC(=O)N(C)CC(=O)O
InChI
InChI=1S/C15H29NO3/c1-3-4-5-6-7-8-9-10-11-12-14(17)16(2)13-15(18)19/h3-13H2,1-2H3,(H,18,19)
InChIKey
BACYUWVYYTXETD-UHFFFAOYSA-N
Compound name
2-[dodecanoyl(methyl)amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

512
References

91117
Patents

271.21475 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.22203 171.8
[M+Na]+ 294.20397 174.3
[M-H]- 270.20747 170.6
[M+NH4]+ 289.24857 187.7
[M+K]+ 310.17791 173.4
[M+H-H2O]+ 254.21201 165.1
[M+HCOO]- 316.21295 191.8
[M+CH3COO]- 330.22860 205.1
[M+Na-2H]- 292.18942 170.5
[M]+ 271.21420 176.6
[M]- 271.21530 176.6
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

No patent data available for this compound.