CID 67225106

4-(methoxymethyl)oxan-4-amine

Structural Information

Molecular Formula
C7H15NO2
SMILES
COCC1(CCOCC1)N
InChI
InChI=1S/C7H15NO2/c1-9-6-7(8)2-4-10-5-3-7/h2-6,8H2,1H3
InChIKey
RKTQBNBFFHFZPT-UHFFFAOYSA-N
Compound name
4-(methoxymethyl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

145.11028 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.117556 130.7
[M+Na]+ 168.099498 135.9
[M-H]- 144.103004 133.9
[M+NH4]+ 163.144103 152.0
[M+K]+ 184.073438 137.0
[M+H-H2O]+ 128.107540 125.7
[M+HCOO]- 190.108481 151.5
[M+CH3COO]- 204.124131 174.0
[M+Na-2H]- 166.084946 138.4
[M]+ 145.10973142 127.7
[M]- 145.11082858 127.7
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