CID 58684204

Methyl[2-(prop-2-yn-1-yloxy)ethyl]amine hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
CNCCOCC#C
InChI
InChI=1S/C6H11NO/c1-3-5-8-6-4-7-2/h1,7H,4-6H2,2H3
InChIKey
LBDGUQLCBNALNC-UHFFFAOYSA-N
Compound name
N-methyl-2-prop-2-ynoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

113.08406 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 121.1
[M+Na]+ 136.07328 129.8
[M-H]- 112.07678 120.8
[M+NH4]+ 131.11788 141.2
[M+K]+ 152.04722 129.0
[M+H-H2O]+ 96.081320 110.5
[M+HCOO]- 158.08226 140.5
[M+CH3COO]- 172.09791 181.4
[M+Na-2H]- 134.05873 127.9
[M]+ 113.08351 117.1
[M]- 113.08461 117.1
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