CID 265934

Methyl hydrazidodicarboxylate

Structural Information

Molecular Formula

C₄H₈N₂O₄

SMILES

COC(=O)NNC(=O)OC

InChI

InChI=1S/C4H8N2O4/c1-9-3(7)5-6-4(8)10-2/h1-2H3,(H,5,7)(H,6,8)

InChIKey

BPJLPBVJCYVEAC-UHFFFAOYSA-N

Compound name

methyl N-(methoxycarbonylamino)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 33
Patents: 148.0484 Da
Monoisotopic Mass: -0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	149.055676	127.7
[M+Na]+	171.037618	134.3
[M-H]-	147.041124	128.5
[M+NH4]+	166.082223	148.4
[M+K]+	187.011558	136.2
[M+H-H2O]+	131.045660	122.2
[M+HCOO]-	193.046601	153.6
[M+CH3COO]-	207.062251	175.5
[M+Na-2H]-	169.023066	133.7
[M]+	148.04785142	129.2
[M]-	148.04894858	129.2

Literature stripe

literature stripe

Patent stripe

patents stripe