CID 10877272

4,4-dimethoxypentan-1-amine

Structural Information

Molecular Formula
C7H17NO2
SMILES
CC(CCCN)(OC)OC
InChI
InChI=1S/C7H17NO2/c1-7(9-2,10-3)5-4-6-8/h4-6,8H2,1-3H3
InChIKey
MPXPIVKBZYOKPI-UHFFFAOYSA-N
Compound name
4,4-dimethoxypentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

147.12593 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.133206 134.0
[M+Na]+ 170.115148 140.3
[M-H]- 146.118654 133.7
[M+NH4]+ 165.159753 155.1
[M+K]+ 186.089088 140.7
[M+H-H2O]+ 130.123190 129.3
[M+HCOO]- 192.124131 156.7
[M+CH3COO]- 206.139781 178.6
[M+Na-2H]- 168.100596 140.3
[M]+ 147.12538142 136.2
[M]- 147.12647858 136.2
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