CID 12372797

N-(prop-2-yn-1-yl)cyclopropanamine

Structural Information

Molecular Formula
C6H9N
SMILES
C#CCNC1CC1
InChI
InChI=1S/C6H9N/c1-2-5-7-6-3-4-6/h1,6-7H,3-5H2
InChIKey
QNJFRCLMHDVMQQ-UHFFFAOYSA-N
Compound name
N-prop-2-ynylcyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

95.0735 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 96.080776 120.4
[M+Na]+ 118.06272 132.0
[M+NH4]+ 113.10732 126.5
[M+K]+ 134.03666 124.7
[M-H]- 94.066224 120.9
[M+Na-2H]- 116.04817 126.1
[M]+ 95.072951 122.3
[M]- 95.074049 122.3
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