CID 75176278

57355-13-2

Structural Information

Molecular Formula

C₁₁H₁₅N₃O₃

SMILES

C[C@H](C(=O)NN)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C11H15N3O3/c1-8(10(15)14-12)13-11(16)17-7-9-5-3-2-4-6-9/h2-6,8H,7,12H2,1H3,(H,13,16)(H,14,15)/t8-/m1/s1

InChIKey

YEORTSCBVGBQMJ-MRVPVSSYSA-N

Compound name

benzyl N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 237.11134 Da
Monoisotopic Mass: 0.4
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]+	238.118616	153.5
[M+Na]+	260.100558	157.2
[M-H]-	236.104064	156.3
[M+NH4]+	255.145163	169.5
[M+K]+	276.074498	156.5
[M+H-H2O]+	220.108600	145.9
[M+HCOO]-	282.109541	177.9
[M+CH3COO]-	296.125191	197.0
[M+Na-2H]-	258.086006	156.7
[M]+	237.11079142	151.5
[M]-	237.11188858	151.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe