CID 493578

L-arginine, n2-(aminocarbonyl)-

Structural Information

Molecular Formula
C7H15N5O3
SMILES
C(C[C@@H](C(=O)O)NC(=O)N)CN=C(N)N
InChI
InChI=1S/C7H15N5O3/c8-6(9)11-3-1-2-4(5(13)14)12-7(10)15/h4H,1-3H2,(H,13,14)(H4,8,9,11)(H3,10,12,15)/t4-/m0/s1
InChIKey
GNRVMKVZOPHHAO-BYPYZUCNSA-N
Compound name
(2S)-2-(carbamoylamino)-5-(diaminomethylideneamino)pentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

23
Patents

217.1175 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.12478 148.0
[M+Na]+ 240.10672 150.4
[M-H]- 216.11022 146.6
[M+NH4]+ 235.15132 163.3
[M+K]+ 256.08066 151.0
[M+H-H2O]+ 200.11476 140.4
[M+HCOO]- 262.11570 171.8
[M+CH3COO]- 276.13135 200.4
[M+Na-2H]- 238.09217 147.4
[M]+ 217.11695 141.8
[M]- 217.11805 141.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe