CID 20719713

Methyl[2-(oxan-4-yl)ethyl]amine

Structural Information

Molecular Formula
C8H17NO
SMILES
CNCCC1CCOCC1
InChI
InChI=1S/C8H17NO/c1-9-5-2-8-3-6-10-7-4-8/h8-9H,2-7H2,1H3
InChIKey
AFRJSXZUSJELQD-UHFFFAOYSA-N
Compound name
N-methyl-2-(oxan-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 132.5
[M+Na]+ 166.12023 136.4
[M-H]- 142.12373 135.7
[M+NH4]+ 161.16483 152.2
[M+K]+ 182.09417 136.8
[M+H-H2O]+ 126.12827 126.6
[M+HCOO]- 188.12921 153.4
[M+CH3COO]- 202.14486 176.1
[M+Na-2H]- 164.10568 139.5
[M]+ 143.13046 129.0
[M]- 143.13156 129.0
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