CID 94131

Isopropylcyanohydrazine

Structural Information

Molecular Formula

C₄H₉N₃

SMILES

CC(C)N(C#N)N

InChI

InChI=1S/C4H9N3/c1-4(2)7(6)3-5/h4H,6H2,1-2H3

InChIKey

VRPHXQGTAUWCFZ-UHFFFAOYSA-N

Compound name

amino(propan-2-yl)cyanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 99.07965 Da
Monoisotopic Mass: 0.6
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]+	100.08693	123.4
[M+Na]+	122.06887	131.8
[M+NH4]+	117.11347	128.1
[M+K]+	138.04281	124.8
[M-H]-	98.072374	117.1
[M+Na-2H]-	120.05432	125.2
[M]+	99.079101	121.7
[M]-	99.080199	121.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe