CID 6475735

Gly-fmdp

Structural Information

Molecular Formula
C10H15N3O6
SMILES
COC(=O)/C=C/C(=O)NCC(C(=O)O)NC(=O)CN
InChI
InChI=1S/C10H15N3O6/c1-19-9(16)3-2-7(14)12-5-6(10(17)18)13-8(15)4-11/h2-3,6H,4-5,11H2,1H3,(H,12,14)(H,13,15)(H,17,18)/b3-2+
InChIKey
NNBAAQACXFIWQJ-NSCUHMNNSA-N
Compound name
2-[(2-aminoacetyl)amino]-3-[[(E)-4-methoxy-4-oxobut-2-enoyl]amino]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

273.0961 Da
Monoisotopic Mass

-4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.10338 160.3
[M+Na]+ 296.08532 162.8
[M-H]- 272.08882 158.1
[M+NH4]+ 291.12992 173.7
[M+K]+ 312.05926 163.3
[M+H-H2O]+ 256.09336 153.2
[M+HCOO]- 318.09430 181.0
[M+CH3COO]- 332.10995 201.8
[M+Na-2H]- 294.07077 158.5
[M]+ 273.09555 159.1
[M]- 273.09665 159.1
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.