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
2
Annotation Hits

0
References

20
Patents

99.07965 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.086926 121.2
[M+Na]+ 122.068868 129.0
[M-H]- 98.072374 123.0
[M+NH4]+ 117.113473 141.9
[M+K]+ 138.042808 130.6
[M+H-H2O]+ 82.076910 109.5
[M+HCOO]- 144.077851 142.7
[M+CH3COO]- 158.093501 188.6
[M+Na-2H]- 120.054316 126.3
[M]+ 99.07910142 114.8
[M]- 99.08019858 114.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe