CID 80398550

Methyl n-methyl-n-[3-(methylamino)propyl]carbamate hydrochloride

Structural Information

Molecular Formula
C7H16N2O2
SMILES
CNCCCN(C)C(=O)OC
InChI
InChI=1S/C7H16N2O2/c1-8-5-4-6-9(2)7(10)11-3/h8H,4-6H2,1-3H3
InChIKey
SAPWQWMOIXIBJW-UHFFFAOYSA-N
Compound name
methyl N-methyl-N-[3-(methylamino)propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.12119 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.128466 137.1
[M+Na]+ 183.110408 142.4
[M-H]- 159.113914 138.7
[M+NH4]+ 178.155013 158.1
[M+K]+ 199.084348 144.1
[M+H-H2O]+ 143.118450 131.1
[M+HCOO]- 205.119391 162.7
[M+CH3COO]- 219.135041 186.0
[M+Na-2H]- 181.095856 141.9
[M]+ 160.12064142 139.7
[M]- 160.12173858 139.7
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

No patent data available for this compound.