CID 18548974

220699-99-0

Structural Information

Molecular Formula
C7H13NO
SMILES
CN(CCOC)CC#C
InChI
InChI=1S/C7H13NO/c1-4-5-8(2)6-7-9-3/h1H,5-7H2,2-3H3
InChIKey
ODTQGXAPSKBFFW-UHFFFAOYSA-N
Compound name
N-(2-methoxyethyl)-N-methylprop-2-yn-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

127.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 124.9
[M+Na]+ 150.08894 133.5
[M-H]- 126.09244 125.8
[M+NH4]+ 145.13354 145.2
[M+K]+ 166.06288 133.5
[M+H-H2O]+ 110.09698 113.9
[M+HCOO]- 172.09792 144.5
[M+CH3COO]- 186.11357 187.3
[M+Na-2H]- 148.07439 130.5
[M]+ 127.09917 122.4
[M]- 127.10027 122.4
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