CID 97616697

1-ethyl-3-methylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H15N
SMILES
CCC1(CC(C1)C)N
InChI
InChI=1S/C7H15N/c1-3-7(8)4-6(2)5-7/h6H,3-5,8H2,1-2H3
InChIKey
XSLNUJQCKAHFGP-UHFFFAOYSA-N
Compound name
1-ethyl-3-methylcyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

113.12045 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.127726 125.7
[M+Na]+ 136.109668 131.8
[M-H]- 112.113174 129.3
[M+NH4]+ 131.154273 143.7
[M+K]+ 152.083608 133.9
[M+H-H2O]+ 96.117710 117.1
[M+HCOO]- 158.118651 147.8
[M+CH3COO]- 172.134301 176.5
[M+Na-2H]- 134.095116 131.5
[M]+ 113.11990142 132.0
[M]- 113.12099858 132.0
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