CID 155821861

4-ethynyl-n,n-dimethyloxan-4-amine

Structural Information

Molecular Formula
C9H15NO
SMILES
CN(C)C1(CCOCC1)C#C
InChI
InChI=1S/C9H15NO/c1-4-9(10(2)3)5-7-11-8-6-9/h1H,5-8H2,2-3H3
InChIKey
VAJRNAPMWPTQON-UHFFFAOYSA-N
Compound name
4-ethynyl-N,N-dimethyloxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 135.2
[M+Na]+ 176.10459 145.5
[M+NH4]+ 171.14919 141.8
[M+K]+ 192.07853 135.5
[M-H]- 152.10809 131.0
[M+Na-2H]- 174.09004 138.9
[M]+ 153.11482 134.8
[M]- 153.11592 134.8
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

No patent data available for this compound.