CID 19401

Tetramin

Structural Information

Molecular Formula
C6H11NO
SMILES
C=CC(CN1CC1)O
InChI
InChI=1S/C6H11NO/c1-2-6(8)5-7-3-4-7/h2,6,8H,1,3-5H2
InChIKey
MJVIZWIQHKRBPI-UHFFFAOYSA-N
Compound name
1-(aziridin-1-yl)but-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

743
Patents

113.08406 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 126.3
[M+Na]+ 136.07328 135.3
[M-H]- 112.07678 128.3
[M+NH4]+ 131.11788 142.3
[M+K]+ 152.04722 132.8
[M+H-H2O]+ 96.081320 120.2
[M+HCOO]- 158.08226 147.4
[M+CH3COO]- 172.09791 171.3
[M+Na-2H]- 134.05873 132.1
[M]+ 113.08351 127.5
[M]- 113.08461 127.5
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