CID 89306669

2503209-13-8

Structural Information

Molecular Formula
C7H11NO
SMILES
C#CC1CC(CCO1)N
InChI
InChI=1S/C7H11NO/c1-2-7-5-6(8)3-4-9-7/h1,6-7H,3-5,8H2
InChIKey
NZYFHLWOCDTTSL-UHFFFAOYSA-N
Compound name
2-ethynyloxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

125.08406 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.09134 128.8
[M+Na]+ 148.07328 139.1
[M+NH4]+ 143.11788 134.0
[M+K]+ 164.04722 130.9
[M-H]- 124.07678 124.2
[M+Na-2H]- 146.05873 130.6
[M]+ 125.08351 128.0
[M]- 125.08461 128.0
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