CID 81176754

1-[(dimethylamino)methyl]cyclobutan-1-amine

Structural Information

Molecular Formula
C7H16N2
SMILES
CN(C)CC1(CCC1)N
InChI
InChI=1S/C7H16N2/c1-9(2)6-7(8)4-3-5-7/h3-6,8H2,1-2H3
InChIKey
OMTAOOUFJIYVKU-UHFFFAOYSA-N
Compound name
1-[(dimethylamino)methyl]cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

128.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 131.9
[M+Na]+ 151.12057 136.0
[M-H]- 127.12407 136.2
[M+NH4]+ 146.16517 149.0
[M+K]+ 167.09451 139.6
[M+H-H2O]+ 111.12861 121.7
[M+HCOO]- 173.12955 155.2
[M+CH3COO]- 187.14520 183.5
[M+Na-2H]- 149.10602 137.3
[M]+ 128.13080 138.0
[M]- 128.13190 138.0
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