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

12
Patents

99.07965 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.08693 121.2
[M+Na]+ 122.06887 129.0
[M-H]- 98.072374 123.0
[M+NH4]+ 117.11347 141.9
[M+K]+ 138.04281 130.6
[M+H-H2O]+ 82.076910 109.5
[M+HCOO]- 144.07785 142.7
[M+CH3COO]- 158.09350 188.6
[M+Na-2H]- 120.05432 126.3
[M]+ 99.079101 114.8
[M]- 99.080199 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