CID 132364517

2155854-85-4

Structural Information

Molecular Formula
C8H17NO2
SMILES
CC1(CCOCC1)OCCN
InChI
InChI=1S/C8H17NO2/c1-8(11-7-4-9)2-5-10-6-3-8/h2-7,9H2,1H3
InChIKey
RQTWAESPWLEJFI-UHFFFAOYSA-N
Compound name
2-(4-methyloxan-4-yl)oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.12593 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 135.3
[M+Na]+ 182.11515 140.0
[M-H]- 158.11865 138.3
[M+NH4]+ 177.15975 156.0
[M+K]+ 198.08909 140.8
[M+H-H2O]+ 142.12319 130.0
[M+HCOO]- 204.12413 155.7
[M+CH3COO]- 218.13978 177.1
[M+Na-2H]- 180.10060 142.4
[M]+ 159.12538 132.6
[M]- 159.12648 132.6
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

No patent data available for this compound.