CID 2735639

6926-09-6

Structural Information

Molecular Formula

C₇H₁₅N₃O₃

SMILES

CC(C)(C)OC(=O)NCC(=O)NN

InChI

InChI=1S/C7H15N3O3/c1-7(2,3)13-6(12)9-4-5(11)10-8/h4,8H2,1-3H3,(H,9,12)(H,10,11)

InChIKey

MQBASTZLTYLEON-UHFFFAOYSA-N

Compound name

tert-butyl N-(2-hydrazinyl-2-oxoethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 420
Patents: 189.11134 Da
Monoisotopic Mass: -0.5
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]+	190.11862	142.5
[M+Na]+	212.10056	147.4
[M+NH4]+	207.14516	147.2
[M+K]+	228.07450	146.0
[M-H]-	188.10406	140.3
[M+Na-2H]-	210.08601	143.4
[M]+	189.11079	141.8
[M]-	189.11189	141.8

Literature stripe

literature stripe

Patent stripe

patents stripe