CID 763

Glycocyamine

Structural Information

Molecular Formula
C3H7N3O2
SMILES
C(C(=O)O)N=C(N)N
InChI
InChI=1S/C3H7N3O2/c4-3(5)6-1-2(7)8/h1H2,(H,7,8)(H4,4,5,6)
InChIKey
BPMFZUMJYQTVII-UHFFFAOYSA-N
Compound name
2-(diaminomethylideneamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

555
References

10739
Patents

117.053825 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.06110 121.6
[M+Na]+ 140.04304 127.6
[M-H]- 116.04655 121.3
[M+NH4]+ 135.08765 142.4
[M+K]+ 156.01698 128.0
[M+H-H2O]+ 100.05108 116.0
[M+HCOO]- 162.05203 146.9
[M+CH3COO]- 176.06768 174.9
[M+Na-2H]- 138.02849 126.0
[M]+ 117.05328 117.2
[M]- 117.05437 117.2
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.