CID 50987580

2-(3,3-dimethylmorpholin-4-yl)ethan-1-amine

Structural Information

Molecular Formula
C8H18N2O
SMILES
CC1(COCCN1CCN)C
InChI
InChI=1S/C8H18N2O/c1-8(2)7-11-6-5-10(8)4-3-9/h3-7,9H2,1-2H3
InChIKey
UMUSYFTZUULERM-UHFFFAOYSA-N
Compound name
2-(3,3-dimethylmorpholin-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

158.1419 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.149176 136.4
[M+Na]+ 181.131118 142.1
[M-H]- 157.134624 138.3
[M+NH4]+ 176.175723 156.2
[M+K]+ 197.105058 142.4
[M+H-H2O]+ 141.139160 130.5
[M+HCOO]- 203.140101 155.3
[M+CH3COO]- 217.155751 178.8
[M+Na-2H]- 179.116566 142.7
[M]+ 158.14135142 133.1
[M]- 158.14244858 133.1
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