CID 165948971

3-(3h-diazirin-3-yl)propan-1-amine hydrochloride

Structural Information

Molecular Formula
C4H9N3
SMILES
C(CC1N=N1)CN
InChI
InChI=1S/C4H9N3/c5-3-1-2-4-6-7-4/h4H,1-3,5H2
InChIKey
GFUHOUFIERYFKT-UHFFFAOYSA-N
Compound name
3-(3H-diazirin-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

99.07965 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.08693 124.7
[M+Na]+ 122.06887 135.1
[M-H]- 98.072374 126.5
[M+NH4]+ 117.11347 140.2
[M+K]+ 138.04281 132.6
[M+H-H2O]+ 82.076910 117.4
[M+HCOO]- 144.07785 149.0
[M+CH3COO]- 158.09350 172.4
[M+Na-2H]- 120.05432 133.1
[M]+ 99.079101 126.9
[M]- 99.080199 126.9
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

No patent data available for this compound.