CID 22491913

2-amino-n,n,4-trimethylpentanamide hydrochloride

Structural Information

Molecular Formula
C8H18N2O
SMILES
CC(C)CC(C(=O)N(C)C)N
InChI
InChI=1S/C8H18N2O/c1-6(2)5-7(9)8(11)10(3)4/h6-7H,5,9H2,1-4H3
InChIKey
VINQQWZFGIKZAZ-UHFFFAOYSA-N
Compound name
2-amino-N,N,4-trimethylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

158.1419 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 140.0
[M+Na]+ 181.13112 144.6
[M-H]- 157.13462 141.1
[M+NH4]+ 176.17572 160.7
[M+K]+ 197.10506 146.1
[M+H-H2O]+ 141.13916 134.3
[M+HCOO]- 203.14010 162.5
[M+CH3COO]- 217.15575 188.8
[M+Na-2H]- 179.11657 140.6
[M]+ 158.14135 139.3
[M]- 158.14245 139.3
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