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

54
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 127.1
[M+Na]+ 150.08894 137.1
[M+NH4]+ 145.13354 131.8
[M+K]+ 166.06288 128.7
[M-H]- 126.09244 119.8
[M+Na-2H]- 148.07439 129.0
[M]+ 127.09917 125.5
[M]- 127.10027 125.5
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