CID 54594344

1-(methoxymethyl)cyclohexan-1-amine

Structural Information

Molecular Formula
C8H17NO
SMILES
COCC1(CCCCC1)N
InChI
InChI=1S/C8H17NO/c1-10-7-8(9)5-3-2-4-6-8/h2-7,9H2,1H3
InChIKey
WHUIPYYPFKFEKJ-UHFFFAOYSA-N
Compound name
1-(methoxymethyl)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 132.4
[M+Na]+ 166.120228 137.1
[M-H]- 142.123734 134.8
[M+NH4]+ 161.164833 155.1
[M+K]+ 182.094168 136.5
[M+H-H2O]+ 126.128270 127.4
[M+HCOO]- 188.129211 153.5
[M+CH3COO]- 202.144861 175.1
[M+Na-2H]- 164.105676 138.4
[M]+ 143.13046142 127.6
[M]- 143.13155858 127.6
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

patents stripe